Product OPENEYE NAME: methyl 6-(diallylamino)-2-hydroxy-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylate hydrochloride
CAS Name: 6-[bis(prop-2-enyl)amino]-2-hydroxy-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylic acid methyl ester hydrochloride
IUPAC NAME: methyl 6-[bis(prop-2-enyl)amino]-2-hydroxy-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylate hydrochloride
SYSTEMATIC NAME: methyl 6-[bis(prop-2-enyl)amino]-2-oxidanyl-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylate hydrochloride
MOLECULAR FORMULA: C19H28ClNO3
MOLECULAR WEIGHT: 353.88352
SMILES: COC(=O)C1(CCCC2=C(C1)C=CC(C2)O)N(CC=C)CC=C.Cl
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Product OPENEYE NAME: methyl 6-(diallylamino)-2-hydroxy-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylate
CAS Name: 6-[bis(prop-2-enyl)amino]-2-hydroxy-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylic acid methyl ester
IUPAC NAME: methyl 6-[bis(prop-2-enyl)amino]-2-hydroxy-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylate
SYSTEMATIC NAME: methyl 6-[bis(prop-2-enyl)amino]-2-oxidanyl-1,2,5,7,8,9-hexahydrobenzo[7]annulene-6-carboxylate
MOLECULAR FORMULA: C19H27NO3
MOLECULAR WEIGHT: 317.42258
SMILES: COC(=O)C1(CCCC2=C(C1)C=CC(C2)O)N(CC=C)CC=C
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Product OPENEYE NAME: 2-methoxy-1,2,5,7,8,9-hexahydrobenzo[7]annulen-6-one
CAS Name: 2-methoxy-1,2,5,7,8,9-hexahydrobenzo[7]annulen-6-one
IUPAC NAME: 2-methoxy-1,2,5,7,8,9-hexahydrobenzo[7]annulen-6-one
SYSTEMATIC NAME: 2-methoxy-1,2,5,7,8,9-hexahydrobenzo[7]annulen-6-one
MOLECULAR FORMULA: C12H16O2
MOLECULAR WEIGHT: 192.25424
SMILES: COC1CC2=C(CC(=O)CCC2)C=C1
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Product OPENEYE NAME: methyl 6-hydroxy-2-(1-piperidyl)tetralin-2-carboxylate hydrochloride
CAS Name: 6-hydroxy-2-(1-piperidinyl)-3,4-dihydro-1H-naphthalene-2-carboxylic acid methyl ester hydrochloride
IUPAC NAME: methyl 6-hydroxy-2-piperidin-1-yl-3,4-dihydro-1H-naphthalene-2-carboxylate hydrochloride
SYSTEMATIC NAME: methyl 6-oxidanyl-2-piperidin-1-yl-3,4-dihydro-1H-naphthalene-2-carboxylate hydrochloride
MOLECULAR FORMULA: C17H24ClNO3
MOLECULAR WEIGHT: 325.83036
SMILES: COC(=O)C1(CCC2=C(C1)C=CC(=C2)O)N3CCCCC3.Cl
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Product OPENEYE NAME: methyl 6-hydroxy-2-(1-piperidyl)tetralin-2-carboxylate
CAS Name: 6-hydroxy-2-(1-piperidinyl)-3,4-dihydro-1H-naphthalene-2-carboxylic acid methyl ester
IUPAC NAME: methyl 6-hydroxy-2-piperidin-1-yl-3,4-dihydro-1H-naphthalene-2-carboxylate
SYSTEMATIC NAME: methyl 6-oxidanyl-2-piperidin-1-yl-3,4-dihydro-1H-naphthalene-2-carboxylate
MOLECULAR FORMULA: C17H23NO3
MOLECULAR WEIGHT: 289.36942
SMILES: COC(=O)C1(CCC2=C(C1)C=CC(=C2)O)N3CCCCC3
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Product OPENEYE NAME: (diallylamino) 1-(cyanomethyl)-6-hydroxy-tetralin-2-carboxylate hydrochloride
CAS Name: 1-(cyanomethyl)-6-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid [bis(prop-2-enyl)amino] ester hydrochloride
IUPAC NAME: [bis(prop-2-enyl)amino] 1-(cyanomethyl)-6-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxylate hydrochloride
SYSTEMATIC NAME: [bis(prop-2-enyl)amino] 1-(cyanomethyl)-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate hydrochloride
MOLECULAR FORMULA: C19H23ClN2O3
MOLECULAR WEIGHT: 362.85052
SMILES: C=CCN(CC=C)OC(=O)C1CCC2=C(C1CC#N)C=CC(=C2)O.Cl
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Product OPENEYE NAME: (diallylamino) 1-(cyanomethyl)-6-hydroxy-tetralin-2-carboxylate
CAS Name: 1-(cyanomethyl)-6-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid [bis(prop-2-enyl)amino] ester
IUPAC NAME: [bis(prop-2-enyl)amino] 1-(cyanomethyl)-6-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxylate
SYSTEMATIC NAME: [bis(prop-2-enyl)amino] 1-(cyanomethyl)-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate
MOLECULAR FORMULA: C19H22N2O3
MOLECULAR WEIGHT: 326.38958
SMILES: C=CCN(CC=C)OC(=O)C1CCC2=C(C1CC#N)C=CC(=C2)O
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Product OPENEYE NAME: (prop-2-ynylamino) 6-hydroxy-1-methyl-tetralin-2-carboxylate hydrochloride
CAS Name: 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid (prop-2-ynylamino) ester hydrochloride
IUPAC NAME: (prop-2-ynylamino) 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate hydrochloride
SYSTEMATIC NAME: (prop-2-ynylamino) 1-methyl-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate hydrochloride
MOLECULAR FORMULA: C15H18ClNO3
MOLECULAR WEIGHT: 295.76132
SMILES: CC1C(CCC2=C1C=CC(=C2)O)C(=O)ONCC#C.Cl
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Product OPENEYE NAME: (prop-2-ynylamino) 6-hydroxy-1-methyl-tetralin-2-carboxylate
CAS Name: 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid (prop-2-ynylamino) ester
IUPAC NAME: (prop-2-ynylamino) 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate
SYSTEMATIC NAME: (prop-2-ynylamino) 1-methyl-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate
MOLECULAR FORMULA: C15H17NO3
MOLECULAR WEIGHT: 259.30038
SMILES: CC1C(CCC2=C1C=CC(=C2)O)C(=O)ONCC#C
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Product OPENEYE NAME: [[3-(2-furyl)-2-methyl-propyl]amino] 6-hydroxy-1-methyl-tetralin-2-carboxylate hydrochloride
CAS Name: 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid [[3-(2-furanyl)-2-methylpropyl]amino] ester hydrochloride
IUPAC NAME: [[3-(furan-2-yl)-2-methylpropyl]amino] 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate hydrochloride
SYSTEMATIC NAME: [[3-(furan-2-yl)-2-methyl-propyl]amino] 1-methyl-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate hydrochloride
MOLECULAR FORMULA: C20H26ClNO4
MOLECULAR WEIGHT: 379.87774
SMILES: CC1C(CCC2=C1C=CC(=C2)O)C(=O)ONCC(C)CC3=CC=CO3.Cl
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Product OPENEYE NAME: 2-acetamido-6-methoxy-tetralin-2-carboxylic acid
CAS Name: 2-acetamido-6-methoxy-3,4-dihydro-1H-naphthalene-2-carboxylic acid
IUPAC NAME: 2-acetamido-6-methoxy-3,4-dihydro-1H-naphthalene-2-carboxylic acid
SYSTEMATIC NAME: 2-acetamido-6-methoxy-3,4-dihydro-1H-naphthalene-2-carboxylic acid
MOLECULAR FORMULA: C14H17NO4
MOLECULAR WEIGHT: 263.28908
SMILES: CC(=O)NC1(CCC2=C(C1)C=CC(=C2)OC)C(=O)O
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Product OPENEYE NAME: (1-ethynylbut-3-enylamino) 6-hydroxy-1-methyl-tetralin-2-carboxylate
CAS Name: 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid (hex-5-en-1-yn-3-ylamino) ester
IUPAC NAME: (hex-5-en-1-yn-3-ylamino) 6-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate
SYSTEMATIC NAME: (hex-5-en-1-yn-3-ylamino) 1-methyl-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate
MOLECULAR FORMULA: C18H21NO3
MOLECULAR WEIGHT: 299.36424
SMILES: CC1C(CCC2=C1C=CC(=C2)O)C(=O)ONC(CC=C)C#C
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Product OPENEYE NAME: 3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]pyrrolidine-2,5-dione
CAS Name: 3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy]pyrrolidine-2,5-dione
IUPAC NAME: 3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C14H16N6O6
MOLECULAR WEIGHT: 364.31344
SMILES: C1C(C(=O)NC1=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O
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Product OPENEYE NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]pyrrolidin-2-one
CAS Name: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy]-2-pyrrolidinone
IUPAC NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]pyrrolidin-2-one
SYSTEMATIC NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]pyrrolidin-2-one
MOLECULAR FORMULA: C14H18N6O5
MOLECULAR WEIGHT: 350.32992
SMILES: C1CC(=O)NC1OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O
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Product OPENEYE NAME: [5-(6-aminopurin-9-yl)-2-[(2,5-dioxopyrrolidin-3-yl)oxymethyl]-4-hydroxy-tetrahydrofuran-3-yl] acetate
CAS Name: acetic acid [5-(6-aminopurin-9-yl)-2-[(2,5-dioxo-3-pyrrolidinyl)oxymethyl]-4-hydroxy-3-oxolanyl] ester
IUPAC NAME: [5-(6-aminopurin-9-yl)-2-[(2,5-dioxopyrrolidin-3-yl)oxymethyl]-4-hydroxyoxolan-3-yl] acetate
SYSTEMATIC NAME: [5-(6-aminopurin-9-yl)-2-[[2,5-bis(oxidanylidene)pyrrolidin-3-yl]oxymethyl]-4-oxidanyl-oxolan-3-yl] ethanoate
MOLECULAR FORMULA: C16H18N6O7
MOLECULAR WEIGHT: 406.35012
SMILES: CC(=O)OC1C(OC(C1O)N2C=NC3=C2N=CN=C3N)COC4CC(=O)NC4=O
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Product OPENEYE NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]-3,3-dimethoxy-pyrrolidin-2-one
CAS Name: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy]-3,3-dimethoxy-2-pyrrolidinone
IUPAC NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-3,3-dimethoxypyrrolidin-2-one
SYSTEMATIC NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]-3,3-dimethoxy-pyrrolidin-2-one
MOLECULAR FORMULA: C16H22N6O7
MOLECULAR WEIGHT: 410.38188
SMILES: COC1(CC(NC1=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O)OC
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Product OPENEYE NAME: [4-acetoxy-2-[acetoxy-(2,5-dioxopyrrolidin-3-yl)methyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3-yl] acetate
CAS Name: acetic acid [4-acetyloxy-2-[acetyloxy-(2,5-dioxo-3-pyrrolidinyl)methyl]-5-(6-aminopurin-9-yl)-3-oxolanyl] ester
IUPAC NAME: [4-acetyloxy-2-[acetyloxy-(2,5-dioxopyrrolidin-3-yl)methyl]-5-(6-aminopurin-9-yl)oxolan-3-yl] acetate
SYSTEMATIC NAME: [4-acetyloxy-2-[acetyloxy-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]methyl]-5-(6-aminopurin-9-yl)oxolan-3-yl] ethanoate
MOLECULAR FORMULA: C20H22N6O9
MOLECULAR WEIGHT: 490.42348
SMILES: CC(=O)OC1C(C(OC1C(C2CC(=O)NC2=O)OC(=O)C)N3C=NC4=C3N=CN=C4N)OC(=O)C
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Product OPENEYE NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]-4-chloro-3,3-dimethoxy-pyrrolidin-2-one
CAS Name: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy]-4-chloro-3,3-dimethoxy-2-pyrrolidinone
IUPAC NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-4-chloro-3,3-dimethoxypyrrolidin-2-one
SYSTEMATIC NAME: 5-[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]-4-chloranyl-3,3-dimethoxy-pyrrolidin-2-one
MOLECULAR FORMULA: C16H21ClN6O7
MOLECULAR WEIGHT: 444.82694
SMILES: COC1(C(C(NC1=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O)Cl)OC
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Product OPENEYE NAME: 1-(2-aminopropanoyl)-1-propyl-pyrrolidin-1-ium-2-carboxylic acid
CAS Name: 1-(2-amino-1-oxopropyl)-1-propyl-2-pyrrolidin-1-iumcarboxylic acid
IUPAC NAME: 1-(2-aminopropanoyl)-1-propylpyrrolidin-1-ium-2-carboxylic acid
SYSTEMATIC NAME: 1-(2-azanylpropanoyl)-1-propyl-pyrrolidin-1-ium-2-carboxylic acid
MOLECULAR FORMULA: C11H21N2O3+
MOLECULAR WEIGHT: 229.29604
SMILES: CCC[N+]1(CCCC1C(=O)O)C(=O)C(C)N
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Product OPENEYE NAME: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide benzoate
CAS Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide benzoate
IUPAC NAME: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide benzoate
SYSTEMATIC NAME: 6-chloranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide benzoate
MOLECULAR FORMULA: C14H13ClN3O6S2-
MOLECULAR WEIGHT: 418.85252
SMILES: C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl.C1=CC=C(C=C1)C(=O)[O-]
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Product OPENEYE NAME: sodium 4-[[(Z)-1-methyl-3-oxo-but-1-enyl]amino]isoxazolidin-3-one
CAS Name: sodium 4-[[(Z)-4-oxopent-2-en-2-yl]amino]-3-isoxazolidinone
IUPAC NAME: sodium 4-[[(Z)-4-oxopent-2-en-2-yl]amino]-1,2-oxazolidin-3-one
SYSTEMATIC NAME: sodium 4-[[(Z)-4-oxidanylidenepent-2-en-2-yl]amino]-1,2-oxazolidin-3-one
MOLECULAR FORMULA: C8H12N2NaO3+
MOLECULAR WEIGHT: 207.18225
SMILES: C/C(=C/C(=O)C)/NC1CONC1=O.[Na+]
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