Product OPENEYE NAME: 2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
CAS Name: 2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
IUPAC NAME: 2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
SYSTEMATIC NAME: 2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: COC1=C(C=C2C3CC4=CC(=C(C=C4CN3CCC2=C1)OC)OC)OC
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Product OPENEYE NAME: dibenzyl benzene-1,3-dicarboxylate
CAS Name: benzene-1,3-dicarboxylic acid bis(phenylmethyl) ester
IUPAC NAME: dibenzyl benzene-1,3-dicarboxylate
SYSTEMATIC NAME: bis(phenylmethyl) benzene-1,3-dicarboxylate
MOLECULAR FORMULA: C22H18O4
MOLECULAR WEIGHT: 346.37592
SMILES: C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)C(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: (1S,4aR,8aS)-1-isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene
CAS Name: (1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
IUPAC NAME: (1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
SYSTEMATIC NAME: (1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
MOLECULAR FORMULA: C15H24
MOLECULAR WEIGHT: 204.35106
SMILES: CC1=CC[C@@H]2[C@@H](C1)[C@@H](CC=C2C)C(C)C
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Product OPENEYE NAME: furo[2,3-h]chromen-2-one
CAS Name: 2-furo[2,3-h][1]benzopyranone
IUPAC NAME: furo[2,3-h]chromen-2-one
SYSTEMATIC NAME: furo[2,3-h]chromen-2-one
MOLECULAR FORMULA: C11H6O3
MOLECULAR WEIGHT: 186.16354
SMILES: C1=CC2=C(C=CO2)C3=C1C=CC(=O)O3
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Product OPENEYE NAME: 5-allyl-4,7-dimethoxy-1,3-benzodioxole
CAS Name: 4,7-dimethoxy-5-prop-2-enyl-1,3-benzodioxole
IUPAC NAME: 4,7-dimethoxy-5-prop-2-enyl-1,3-benzodioxole
SYSTEMATIC NAME: 4,7-dimethoxy-5-prop-2-enyl-1,3-benzodioxole
MOLECULAR FORMULA: C12H14O4
MOLECULAR WEIGHT: 222.23716
SMILES: COC1=C2C(=C(C(=C1)CC=C)OC)OCO2
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Product OPENEYE NAME: 2-benzhydryloxy-N,N-dimethyl-ethanamine; 8-chloro-1,3-dimethyl-7H-purine-2,6-dione
CAS Name: 8-chloro-1,3-dimethyl-7H-purine-2,6-dione; 2-(diphenylmethyl)oxy-N,N-dimethylethanamine
IUPAC NAME: 2-benzhydryloxy-N,N-dimethylethanamine; 8-chloro-1,3-dimethyl-7H-purine-2,6-dione
SYSTEMATIC NAME: 8-chloranyl-1,3-dimethyl-7H-purine-2,6-dione; 2-(diphenylmethyl)oxy-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C24H28ClN5O3
MOLECULAR WEIGHT: 469.96382
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: 8-chloro-1,3-dimethyl-7H-purine-2,6-dione
CAS Name: 8-chloro-1,3-dimethyl-7H-purine-2,6-dione
IUPAC NAME: 8-chloro-1,3-dimethyl-7H-purine-2,6-dione
SYSTEMATIC NAME: 8-chloranyl-1,3-dimethyl-7H-purine-2,6-dione
MOLECULAR FORMULA: C7H7ClN4O2
MOLECULAR WEIGHT: 214.60908
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl
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Product OPENEYE NAME: 1,2-bis(5-bromo-2-hydroxy-phenyl)ethane-1,2-dione
CAS Name: 1,2-bis(5-bromo-2-hydroxyphenyl)ethane-1,2-dione
IUPAC NAME: 1,2-bis(5-bromo-2-hydroxyphenyl)ethane-1,2-dione
SYSTEMATIC NAME: 1,2-bis(5-bromanyl-2-oxidanyl-phenyl)ethane-1,2-dione
MOLECULAR FORMULA: C14H8Br2O4
MOLECULAR WEIGHT: 400.01892
SMILES: C1=CC(=C(C=C1Br)C(=O)C(=O)C2=C(C=CC(=C2)Br)O)O
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Product OPENEYE NAME: 3-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-3-oxo-propanoic acid
CAS Name: 3-[2-[[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethyl-1-oxobutyl]amino]-1-oxopropyl]amino]ethylthio]-3-oxopropanoic acid
IUPAC NAME: 3-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-oxopropanoic acid
SYSTEMATIC NAME: 3-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-3-oxidanylidene-propanoic acid
MOLECULAR FORMULA: C24H38N7O19P3S
MOLECULAR WEIGHT: 853.580303
SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(=O)O)O
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Product OPENEYE NAME: 4-(aminomethyl)-5-(hydroxymethyl)-2-methyl-pyridin-3-ol dihydrochloride
CAS Name: 4-(aminomethyl)-5-(hydroxymethyl)-2-methyl-3-pyridinol dihydrochloride
IUPAC NAME: 4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol dihydrochloride
SYSTEMATIC NAME: 4-(aminomethyl)-5-(hydroxymethyl)-2-methyl-pyridin-3-ol dihydrochloride
MOLECULAR FORMULA: C8H14Cl2N2O2
MOLECULAR WEIGHT: 241.11496
SMILES: CC1=NC=C(C(=C1O)CN)CO.Cl.Cl
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Product OPENEYE NAME: 2-hydroxyisoindoline-1,3-dione
CAS Name: 2-hydroxyisoindole-1,3-dione
IUPAC NAME: 2-hydroxyisoindole-1,3-dione
SYSTEMATIC NAME: 2-oxidanylisoindole-1,3-dione
MOLECULAR FORMULA: C8H5NO3
MOLECULAR WEIGHT: 163.1302
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)O
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Product OPENEYE NAME: 4-methoxy-1-methyl-2-oxo-pyridine-3-carbonitrile
CAS Name: 4-methoxy-1-methyl-2-oxo-3-pyridinecarbonitrile
IUPAC NAME: 4-methoxy-1-methyl-2-oxopyridine-3-carbonitrile
SYSTEMATIC NAME: 4-methoxy-1-methyl-2-oxidanylidene-pyridine-3-carbonitrile
MOLECULAR FORMULA: C8H8N2O2
MOLECULAR WEIGHT: 164.16132
SMILES: CN1C=CC(=C(C1=O)C#N)OC
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Product OPENEYE NAME: naphthalene-1,2-dione
CAS Name: naphthalene-1,2-dione
IUPAC NAME: naphthalene-1,2-dione
SYSTEMATIC NAME: naphthalene-1,2-dione
MOLECULAR FORMULA: C10H6O2
MOLECULAR WEIGHT: 158.15344
SMILES: C1=CC=C2C(=C1)C=CC(=O)C2=O
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Product OPENEYE NAME: N,N-dimethyl-4,4-bis(2-thienyl)but-3-en-2-amine
CAS Name: N,N-dimethyl-4,4-dithiophen-2-yl-3-buten-2-amine
IUPAC NAME: N,N-dimethyl-4,4-dithiophen-2-ylbut-3-en-2-amine
SYSTEMATIC NAME: N,N-dimethyl-4,4-dithiophen-2-yl-but-3-en-2-amine
MOLECULAR FORMULA: C14H17NS2
MOLECULAR WEIGHT: 263.42148
SMILES: CC(C=C(C1=CC=CS1)C2=CC=CS2)N(C)C
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Product OPENEYE NAME: 2-[(4-methoxyphenyl)-phenyl-methoxy]-N,N-dimethyl-ethanamine
CAS Name: 2-[(4-methoxyphenyl)-phenylmethoxy]-N,N-dimethylethanamine
IUPAC NAME: 2-[(4-methoxyphenyl)-phenylmethoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-[(4-methoxyphenyl)-phenyl-methoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C18H23NO2
MOLECULAR WEIGHT: 285.38072
SMILES: CN(C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: 2-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)ethanamine hydrochloride
CAS Name: 2-[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]ethanamine hydrochloride
IUPAC NAME: 2-(1-benzyl-5-methoxy-2-methylindol-3-yl)ethanamine hydrochloride
SYSTEMATIC NAME: 2-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]ethanamine hydrochloride
MOLECULAR FORMULA: C19H23ClN2O
MOLECULAR WEIGHT: 330.85172
SMILES: CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)CCN.Cl
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Product OPENEYE NAME: 9H-fluoren-9-amine
CAS Name: 9H-fluoren-9-amine
IUPAC NAME: 9H-fluoren-9-amine
SYSTEMATIC NAME: 9H-fluoren-9-amine
MOLECULAR FORMULA: C13H11N
MOLECULAR WEIGHT: 181.23314
SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)N
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Product OPENEYE NAME: disodium 3-hydroxy-4-nitroso-naphthalene-2,7-disulfonate
CAS Name: disodium 3-hydroxy-4-nitrosonaphthalene-2,7-disulfonate
IUPAC NAME: disodium 3-hydroxy-4-nitrosonaphthalene-2,7-disulfonate
SYSTEMATIC NAME: disodium 4-nitroso-3-oxidanyl-naphthalene-2,7-disulfonate
MOLECULAR FORMULA: C10H5NNa2O8S2
MOLECULAR WEIGHT: 377.25814
SMILES: C1=CC2=C(C(=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])O)N=O.[Na+].[Na+]
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Product OPENEYE NAME: 3-hydroxy-4-nitroso-naphthalene-2,7-disulfonic acid
CAS Name: 3-hydroxy-4-nitrosonaphthalene-2,7-disulfonic acid
IUPAC NAME: 3-hydroxy-4-nitrosonaphthalene-2,7-disulfonic acid
SYSTEMATIC NAME: 4-nitroso-3-oxidanyl-naphthalene-2,7-disulfonic acid
MOLECULAR FORMULA: C10H7NO8S2
MOLECULAR WEIGHT: 333.29448
SMILES: C1=CC2=C(C(=C(C=C2C=C1S(=O)(=O)O)S(=O)(=O)O)O)N=O
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Product OPENEYE NAME: 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione hydrochloride
CAS Name: 3-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-1H-quinazoline-2,4-dione hydrochloride
IUPAC NAME: 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione hydrochloride
SYSTEMATIC NAME: 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione hydrochloride
MOLECULAR FORMULA: C21H24Cl2N4O2
MOLECULAR WEIGHT: 435.34686
SMILES: C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3NC2=O)C4=CC(=CC=C4)Cl.Cl
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Product OPENEYE NAME: 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione
CAS Name: 3-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-1H-quinazoline-2,4-dione
IUPAC NAME: 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione
SYSTEMATIC NAME: 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione
MOLECULAR FORMULA: C21H23ClN4O2
MOLECULAR WEIGHT: 398.88592
SMILES: C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3NC2=O)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: naphthalene-1,6-disulfonic acid
CAS Name: naphthalene-1,6-disulfonic acid
IUPAC NAME: naphthalene-1,6-disulfonic acid
SYSTEMATIC NAME: naphthalene-1,6-disulfonic acid
MOLECULAR FORMULA: C10H8O6S2
MOLECULAR WEIGHT: 288.29692
SMILES: C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C(=C1)S(=O)(=O)O
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