Product OPENEYE NAME: 4-methyl-1-thioxo-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
CAS Name: 4-methyl-1-sulfanylidene-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
IUPAC NAME: 4-methyl-1-sulfanylidene-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
SYSTEMATIC NAME: 4-methyl-1-sulfanylidene-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
MOLECULAR FORMULA: C5H9O3PS
MOLECULAR WEIGHT: 180.161921
SMILES: CC12COP(=S)(OC1)OC2
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Product OPENEYE NAME: (4-cyclopentyl-4-hydroxy-4-phenyl-but-2-ynyl)-diethyl-ammonium chloride
CAS Name: (4-cyclopentyl-4-hydroxy-4-phenylbut-2-ynyl)-diethylammonium chloride
IUPAC NAME: (4-cyclopentyl-4-hydroxy-4-phenylbut-2-ynyl)-diethylazanium chloride
SYSTEMATIC NAME: (4-cyclopentyl-4-oxidanyl-4-phenyl-but-2-ynyl)-diethyl-azanium chloride
MOLECULAR FORMULA: C19H28ClNO
MOLECULAR WEIGHT: 321.88472
SMILES: CC[NH+](CC)CC#CC(C1CCCC1)(C2=CC=CC=C2)O.[Cl-]
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Product OPENEYE NAME: 1-cyclopentyl-4-(diethylamino)-1-phenyl-but-2-yn-1-ol
CAS Name: 1-cyclopentyl-4-(diethylamino)-1-phenyl-2-butyn-1-ol
IUPAC NAME: 1-cyclopentyl-4-(diethylamino)-1-phenylbut-2-yn-1-ol
SYSTEMATIC NAME: 1-cyclopentyl-4-(diethylamino)-1-phenyl-but-2-yn-1-ol
MOLECULAR FORMULA: C19H27NO
MOLECULAR WEIGHT: 285.42378
SMILES: CCN(CC)CC#CC(C1CCCC1)(C2=CC=CC=C2)O
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Product OPENEYE NAME: 1-[(3,4-dihydroxyphenyl)-hydroxy-methyl]propylammonium chloride
CAS Name: [1-(3,4-dihydroxyphenyl)-1-hydroxybutan-2-yl]ammonium chloride
IUPAC NAME: [1-(3,4-dihydroxyphenyl)-1-hydroxybutan-2-yl]azanium chloride
SYSTEMATIC NAME: [1-[3,4-bis(oxidanyl)phenyl]-1-oxidanyl-butan-2-yl]azanium chloride
MOLECULAR FORMULA: C10H16ClNO3
MOLECULAR WEIGHT: 233.69194
SMILES: CCC(C(C1=CC(=C(C=C1)O)O)O)[NH3+].[Cl-]
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Product OPENEYE NAME: 4-(2-amino-1-hydroxy-butyl)benzene-1,2-diol
CAS Name: 4-(2-amino-1-hydroxybutyl)benzene-1,2-diol
IUPAC NAME: 4-(2-amino-1-hydroxybutyl)benzene-1,2-diol
SYSTEMATIC NAME: 4-(2-azanyl-1-oxidanyl-butyl)benzene-1,2-diol
MOLECULAR FORMULA: C10H15NO3
MOLECULAR WEIGHT: 197.231
SMILES: CCC(C(C1=CC(=C(C=C1)O)O)O)N
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Product OPENEYE NAME: 5,6,7,8-tetrahydroacridin-4-amine
CAS Name: 5,6,7,8-tetrahydroacridin-4-amine
IUPAC NAME: 5,6,7,8-tetrahydroacridin-4-amine
SYSTEMATIC NAME: 5,6,7,8-tetrahydroacridin-4-amine
MOLECULAR FORMULA: C13H14N2
MOLECULAR WEIGHT: 198.26366
SMILES: C1CCC2=C(C1)C=C3C=CC=C(C3=N2)N
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Product OPENEYE NAME: trimethyl-[2-[2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propoxy]ethyl]ammonium iodide
CAS Name: trimethyl-[2-[2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propoxy]ethyl]ammonium iodide
IUPAC NAME: trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium iodide
SYSTEMATIC NAME: trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium iodide
MOLECULAR FORMULA: C23H34INO2
MOLECULAR WEIGHT: 483.42603
SMILES: C[N+](C)(C)CCOCC(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.[I-]
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Product OPENEYE NAME: trimethyl-[2-[2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propoxy]ethyl]ammonium
CAS Name: trimethyl-[2-[2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propoxy]ethyl]ammonium
IUPAC NAME: trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium
SYSTEMATIC NAME: trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium
MOLECULAR FORMULA: C23H34NO2+
MOLECULAR WEIGHT: 356.52156
SMILES: C[N+](C)(C)CCOCC(CC1CCCO1)CC2=CC=CC3=CC=CC=C32
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Product OPENEYE NAME: diethyl-[2-[2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoyl]oxyethyl]ammonium; 2-hydroxy-2-oxo-acetate
CAS Name: diethyl-[2-[2-(1-naphthalenylmethyl)-1-oxo-3-(2-oxolanyl)propoxy]ethyl]ammonium; 2-hydroxy-2-oxoacetate
IUPAC NAME: diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-hydroxy-2-oxoacetate
SYSTEMATIC NAME: diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C26H35NO7
MOLECULAR WEIGHT: 473.5586
SMILES: CC[NH+](CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)[O-])O
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Product OPENEYE NAME: N,N'-bis(3-methoxyphenyl)formamidine
CAS Name: N,N'-bis(3-methoxyphenyl)methanimidamide
IUPAC NAME: N,N'-bis(3-methoxyphenyl)methanimidamide
SYSTEMATIC NAME: N,N'-bis(3-methoxyphenyl)methanimidamide
MOLECULAR FORMULA: C15H16N2O2
MOLECULAR WEIGHT: 256.29974
SMILES: COC1=CC=CC(=C1)NC=NC2=CC(=CC=C2)OC
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Product OPENEYE NAME: 2,3,4,4-tetrachlorocyclobut-2-en-1-one
CAS Name: 2,3,4,4-tetrachloro-1-cyclobut-2-enone
IUPAC NAME: 2,3,4,4-tetrachlorocyclobut-2-en-1-one
SYSTEMATIC NAME: 2,3,4,4-tetrakis(chloranyl)cyclobut-2-en-1-one
MOLECULAR FORMULA: C4Cl4O
MOLECULAR WEIGHT: 205.8542
SMILES: C1(=C(C(C1=O)(Cl)Cl)Cl)Cl
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Product OPENEYE NAME: ethyl N-(4-methyloxazol-5-yl)-N-propyl-carbamate
CAS Name: N-(4-methyl-5-oxazolyl)-N-propylcarbamic acid ethyl ester
IUPAC NAME: ethyl N-(4-methyl-1,3-oxazol-5-yl)-N-propylcarbamate
SYSTEMATIC NAME: ethyl N-(4-methyl-1,3-oxazol-5-yl)-N-propyl-carbamate
MOLECULAR FORMULA: C10H16N2O3
MOLECULAR WEIGHT: 212.24564
SMILES: CCCN(C1=C(N=CO1)C)C(=O)OCC
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Product OPENEYE NAME: 2-(1,3-benzodioxol-5-ylmethylamino)propanoic acid
CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)propanoic acid
IUPAC NAME: 2-(1,3-benzodioxol-5-ylmethylamino)propanoic acid
SYSTEMATIC NAME: 2-(1,3-benzodioxol-5-ylmethylamino)propanoic acid
MOLECULAR FORMULA: C11H13NO4
MOLECULAR WEIGHT: 223.22522
SMILES: CC(C(=O)O)NCC1=CC2=C(C=C1)OCO2
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Product OPENEYE NAME: 1-(2-furyl)-N-methyl-2-phenyl-ethanamine
CAS Name: 1-(2-furanyl)-N-methyl-2-phenylethanamine
IUPAC NAME: 1-(furan-2-yl)-N-methyl-2-phenylethanamine
SYSTEMATIC NAME: 1-(furan-2-yl)-N-methyl-2-phenyl-ethanamine
MOLECULAR FORMULA: C13H15NO
MOLECULAR WEIGHT: 201.2643
SMILES: CNC(CC1=CC=CC=C1)C2=CC=CO2
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Product OPENEYE NAME: N-[1-(2-furyl)-2-phenyl-ethyl]propan-1-amine
CAS Name: N-[1-(2-furanyl)-2-phenylethyl]-1-propanamine
IUPAC NAME: N-[1-(furan-2-yl)-2-phenylethyl]propan-1-amine
SYSTEMATIC NAME: N-[1-(furan-2-yl)-2-phenyl-ethyl]propan-1-amine
MOLECULAR FORMULA: C15H19NO
MOLECULAR WEIGHT: 229.31746
SMILES: CCCNC(CC1=CC=CC=C1)C2=CC=CO2
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Product OPENEYE NAME: 2-[ethyl(propyl)amino]ethyl 2-hydroxy-2,2-diphenyl-acetate hydrochloride
CAS Name: 2-hydroxy-2,2-diphenylacetic acid 2-[ethyl(propyl)amino]ethyl ester hydrochloride
IUPAC NAME: 2-[ethyl(propyl)amino]ethyl 2-hydroxy-2,2-diphenylacetate hydrochloride
SYSTEMATIC NAME: 2-[ethyl(propyl)amino]ethyl 2-oxidanyl-2,2-diphenyl-ethanoate hydrochloride
MOLECULAR FORMULA: C21H28ClNO3
MOLECULAR WEIGHT: 377.90492
SMILES: CCCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl
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Product OPENEYE NAME: 2-[ethyl(propyl)amino]ethyl 2-hydroxy-2,2-diphenyl-acetate
CAS Name: 2-hydroxy-2,2-diphenylacetic acid 2-[ethyl(propyl)amino]ethyl ester
IUPAC NAME: 2-[ethyl(propyl)amino]ethyl 2-hydroxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-[ethyl(propyl)amino]ethyl 2-oxidanyl-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C21H27NO3
MOLECULAR WEIGHT: 341.44398
SMILES: CCCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O
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Product OPENEYE NAME: 3-cyclohexylcyclobutanecarboxylic acid
CAS Name: 3-cyclohexyl-1-cyclobutanecarboxylic acid
IUPAC NAME: 3-cyclohexylcyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 3-cyclohexylcyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C11H18O2
MOLECULAR WEIGHT: 182.25942
SMILES: C1CCC(CC1)C2CC(C2)C(=O)O
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Product OPENEYE NAME: 2-ethylfuran
CAS Name: 2-ethylfuran
IUPAC NAME: 2-ethylfuran
SYSTEMATIC NAME: 2-ethylfuran
MOLECULAR FORMULA: C6H8O
MOLECULAR WEIGHT: 96.12712
SMILES: CCC1=CC=CO1
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Product OPENEYE NAME: 1,2-dichloro-3-nitro-benzene
CAS Name: 1,2-dichloro-3-nitrobenzene
IUPAC NAME: 1,2-dichloro-3-nitrobenzene
SYSTEMATIC NAME: 1,2-bis(chloranyl)-3-nitro-benzene
MOLECULAR FORMULA: C6H3Cl2NO2
MOLECULAR WEIGHT: 191.99952
SMILES: C1=CC(=C(C(=C1)Cl)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: 2-hydroxy-2-oxo-acetate; 2-pyrrolidin-1-ium-1-ylethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-hydroxy-2-oxoacetate; 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(1-pyrrolidin-1-iumyl)ethyl ester
IUPAC NAME: 2-hydroxy-2-oxoacetate; 2-pyrrolidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-oxidanyl-2-oxidanylidene-ethanoate; 2-pyrrolidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
MOLECULAR FORMULA: C26H33NO7
MOLECULAR WEIGHT: 471.54272
SMILES: C1CC[NH+](C1)CCOC(=O)C(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O
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