Product OPENEYE NAME: 2-(4-chlorophenoxy)propanoic acid
CAS Name: 2-(4-chlorophenoxy)propanoic acid
IUPAC NAME: 2-(4-chlorophenoxy)propanoic acid
SYSTEMATIC NAME: 2-(4-chloranylphenoxy)propanoic acid
MOLECULAR FORMULA: C9H9ClO3
MOLECULAR WEIGHT: 200.61896
SMILES: CC(C(=O)O)OC1=CC=C(C=C1)Cl
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Product OPENEYE NAME: 2-(3,4-dichlorophenoxy)propanoic acid
CAS Name: 2-(3,4-dichlorophenoxy)propanoic acid
IUPAC NAME: 2-(3,4-dichlorophenoxy)propanoic acid
SYSTEMATIC NAME: 2-[3,4-bis(chloranyl)phenoxy]propanoic acid
MOLECULAR FORMULA: C9H8Cl2O3
MOLECULAR WEIGHT: 235.06402
SMILES: CC(C(=O)O)OC1=CC(=C(C=C1)Cl)Cl
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Product OPENEYE NAME: 2-phenylpyridin-3-ol
CAS Name: 2-phenyl-3-pyridinol
IUPAC NAME: 2-phenylpyridin-3-ol
SYSTEMATIC NAME: 2-phenylpyridin-3-ol
MOLECULAR FORMULA: C11H9NO
MOLECULAR WEIGHT: 171.19526
SMILES: C1=CC=C(C=C1)C2=C(C=CC=N2)O
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Product OPENEYE NAME: [4-(3-carboxypropyl)phenyl]-bis(2-chloroethyl)ammonium chloride
CAS Name: [4-(3-carboxypropyl)phenyl]-bis(2-chloroethyl)ammonium chloride
IUPAC NAME: [4-(3-carboxypropyl)phenyl]-bis(2-chloroethyl)azanium chloride
SYSTEMATIC NAME: bis(2-chloroethyl)-[4-(4-oxidanyl-4-oxidanylidene-butyl)phenyl]azanium chloride
MOLECULAR FORMULA: C14H20Cl3NO2
MOLECULAR WEIGHT: 340.6731
SMILES: C1=CC(=CC=C1CCCC(=O)O)[NH+](CCCl)CCCl.[Cl-]
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Product OPENEYE NAME: 2-[2-(4-ethoxyphenoxy)benzimidazol-1-yl]-N,N-diethyl-ethanamine
CAS Name: 2-[2-(4-ethoxyphenoxy)-1-benzimidazolyl]-N,N-diethylethanamine
IUPAC NAME: 2-[2-(4-ethoxyphenoxy)benzimidazol-1-yl]-N,N-diethylethanamine
SYSTEMATIC NAME: 2-[2-(4-ethoxyphenoxy)benzimidazol-1-yl]-N,N-diethyl-ethanamine
MOLECULAR FORMULA: C21H27N3O2
MOLECULAR WEIGHT: 353.45798
SMILES: CCN(CC)CCN1C2=CC=CC=C2N=C1OC3=CC=C(C=C3)OCC
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Product OPENEYE NAME: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)ethyl-dimethyl-ammonium chloride
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)ethyl-dimethylammonium chloride
IUPAC NAME: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)ethyl-dimethylazanium chloride
SYSTEMATIC NAME: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)ethyl-dimethyl-azanium chloride
MOLECULAR FORMULA: C12H18ClNO3
MOLECULAR WEIGHT: 259.72922
SMILES: C[NH+](C)CCOC1=CC2=C(C=C1)OCCO2.[Cl-]
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Product OPENEYE NAME: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)-N,N-dimethyl-ethanamine
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)-N,N-dimethylethanamine
IUPAC NAME: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C12H17NO3
MOLECULAR WEIGHT: 223.26828
SMILES: CN(C)CCOC1=CC2=C(C=C1)OCCO2
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Product OPENEYE NAME: 3-methyl-1,2-dihydrobenzo[j]aceanthrylen-2-ol
CAS Name: 3-methyl-1,2-dihydrobenzo[j]aceanthrylen-2-ol
IUPAC NAME: 3-methyl-1,2-dihydrobenzo[j]aceanthrylen-2-ol
SYSTEMATIC NAME: 3-methyl-1,2-dihydrobenzo[j]aceanthrylen-2-ol
MOLECULAR FORMULA: C21H16O
MOLECULAR WEIGHT: 284.35114
SMILES: CC1=C2C(CC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)O
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Product OPENEYE NAME: methyl 7-isopropylidene-1,4a-dimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
CAS Name: 1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester
IUPAC NAME: methyl 1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
SYSTEMATIC NAME: methyl 1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
MOLECULAR FORMULA: C21H32O2
MOLECULAR WEIGHT: 316.47758
SMILES: CC(=C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)OC)C)C
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Product OPENEYE NAME: 2-amino-4-methoxy-butanoic acid
CAS Name: 2-amino-4-methoxybutanoic acid
IUPAC NAME: 2-amino-4-methoxybutanoic acid
SYSTEMATIC NAME: 2-azanyl-4-methoxy-butanoic acid
MOLECULAR FORMULA: C5H11NO3
MOLECULAR WEIGHT: 133.14574
SMILES: COCCC(C(=O)O)N
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Product OPENEYE NAME: 5-methyl-11-[3-(1-piperidyl)propyl]-6,11-dihydrobenzo[c][1]benzazepine
CAS Name: 5-methyl-11-[3-(1-piperidinyl)propyl]-6,11-dihydrobenzo[c][1]benzazepine
IUPAC NAME: 5-methyl-11-(3-piperidin-1-ylpropyl)-6,11-dihydrobenzo[c][1]benzazepine
SYSTEMATIC NAME: 5-methyl-11-(3-piperidin-1-ylpropyl)-6,11-dihydrobenzo[c][1]benzazepine
MOLECULAR FORMULA: C23H30N2
MOLECULAR WEIGHT: 334.4977
SMILES: CN1CC2=CC=CC=C2C(C3=CC=CC=C31)CCCN4CCCCC4
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Product OPENEYE NAME: N-methyl-3-(5-methyl-6,11-dihydrobenzo[c][1]benzazepin-11-yl)propan-1-amine
CAS Name: N-methyl-3-(5-methyl-6,11-dihydrobenzo[c][1]benzazepin-11-yl)-1-propanamine
IUPAC NAME: N-methyl-3-(5-methyl-6,11-dihydrobenzo[c][1]benzazepin-11-yl)propan-1-amine
SYSTEMATIC NAME: N-methyl-3-(5-methyl-6,11-dihydrobenzo[c][1]benzazepin-11-yl)propan-1-amine
MOLECULAR FORMULA: C19H24N2
MOLECULAR WEIGHT: 280.40726
SMILES: CNCCCC1C2=CC=CC=C2CN(C3=CC=CC=C13)C
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Product OPENEYE NAME: N'-cyclohexylpropane-1,3-diamine
CAS Name: N'-cyclohexylpropane-1,3-diamine
IUPAC NAME: N'-cyclohexylpropane-1,3-diamine
SYSTEMATIC NAME: N'-cyclohexylpropane-1,3-diamine
MOLECULAR FORMULA: C9H20N2
MOLECULAR WEIGHT: 156.2685
SMILES: C1CCC(CC1)NCCCN
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Product OPENEYE NAME: N-[1-(hydrazinecarbonyl)-2-methyl-3-phenyl-propyl]acetamide
CAS Name: N-(1-hydrazinyl-3-methyl-1-oxo-4-phenylbutan-2-yl)acetamide
IUPAC NAME: N-(1-hydrazinyl-3-methyl-1-oxo-4-phenylbutan-2-yl)acetamide
SYSTEMATIC NAME: N-(1-diazanyl-3-methyl-1-oxidanylidene-4-phenyl-butan-2-yl)ethanamide
MOLECULAR FORMULA: C13H19N3O2
MOLECULAR WEIGHT: 249.30886
SMILES: CC(CC1=CC=CC=C1)C(C(=O)NN)NC(=O)C
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Product OPENEYE NAME: 2-(1,3-benzodioxol-5-yl)-1,3-benzoxazole
CAS Name: 2-(1,3-benzodioxol-5-yl)-1,3-benzoxazole
IUPAC NAME: 2-(1,3-benzodioxol-5-yl)-1,3-benzoxazole
SYSTEMATIC NAME: 2-(1,3-benzodioxol-5-yl)-1,3-benzoxazole
MOLECULAR FORMULA: C14H9NO3
MOLECULAR WEIGHT: 239.22616
SMILES: C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4O3
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Product OPENEYE NAME: [4-(5,7-diacetoxy-4-oxo-chromen-2-yl)phenyl] acetate
CAS Name: acetic acid [4-(5,7-diacetyloxy-4-oxo-1-benzopyran-2-yl)phenyl] ester
IUPAC NAME: [4-(5,7-diacetyloxy-4-oxochromen-2-yl)phenyl] acetate
SYSTEMATIC NAME: [4-(5,7-diacetyloxy-4-oxidanylidene-chromen-2-yl)phenyl] ethanoate
MOLECULAR FORMULA: C21H16O8
MOLECULAR WEIGHT: 396.34694
SMILES: CC(=O)OC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC(=O)C)OC(=O)C
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Product OPENEYE NAME: 2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]-3-ethyl-9,10-dimethoxy-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine chloride
CAS Name: 2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]-3-ethyl-9,10-dimethoxy-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine chloride
IUPAC NAME: 2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]-3-ethyl-9,10-dimethoxy-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine chloride
SYSTEMATIC NAME: 2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]-3-ethyl-9,10-dimethoxy-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine chloride
MOLECULAR FORMULA: C29H39ClN2O4
MOLECULAR WEIGHT: 515.08396
SMILES: CCC1=C(CC2C3=CC(=C(C=C3CCN2C1)OC)OC)CC4C5=CC(=C(C=C5CC[NH2+]4)OC)OC.[Cl-]
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Product OPENEYE NAME: 1-phenylpentane-2,4-dione
CAS Name: 1-phenylpentane-2,4-dione
IUPAC NAME: 1-phenylpentane-2,4-dione
SYSTEMATIC NAME: 1-phenylpentane-2,4-dione
MOLECULAR FORMULA: C11H12O2
MOLECULAR WEIGHT: 176.21178
SMILES: CC(=O)CC(=O)CC1=CC=CC=C1
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Product OPENEYE NAME: 1-cyclohexylpiperidine
CAS Name: 1-cyclohexylpiperidine
IUPAC NAME: 1-cyclohexylpiperidine
SYSTEMATIC NAME: 1-cyclohexylpiperidine
MOLECULAR FORMULA: C11H21N
MOLECULAR WEIGHT: 167.29114
SMILES: C1CCC(CC1)N2CCCCC2
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Product OPENEYE NAME: tris(2-ethylhexyl) benzene-1,2,4-tricarboxylate
CAS Name: benzene-1,2,4-tricarboxylic acid tris(2-ethylhexyl) ester
IUPAC NAME: tris(2-ethylhexyl) benzene-1,2,4-tricarboxylate
SYSTEMATIC NAME: tris(2-ethylhexyl) benzene-1,2,4-tricarboxylate
MOLECULAR FORMULA: C33H54O6
MOLECULAR WEIGHT: 546.77826
SMILES: CCCCC(CC)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC
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