Product OPENEYE NAME: 2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-ol bromide
CAS Name: 2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-ol bromide
IUPAC NAME: 2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-ol bromide
SYSTEMATIC NAME: 2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-ol bromide
MOLECULAR FORMULA: C11H22BrNO
MOLECULAR WEIGHT: 264.20248
SMILES: CC[NH+]1CCC2C(C1)CCCC2O.[Br-]
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Product OPENEYE NAME: 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
CAS Name: 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
IUPAC NAME: 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
SYSTEMATIC NAME: 2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-ol
MOLECULAR FORMULA: C11H21NO
MOLECULAR WEIGHT: 183.29054
SMILES: CCN1CCC2C(C1)CCCC2O
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Product OPENEYE NAME: (2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-yl) 3,4,5-trimethoxybenzoate bromide
CAS Name: 3,4,5-trimethoxybenzoic acid (2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-yl) ester bromide
IUPAC NAME: (2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-yl) 3,4,5-trimethoxybenzoate bromide
SYSTEMATIC NAME: (2-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-5-yl) 3,4,5-trimethoxybenzoate bromide
MOLECULAR FORMULA: C21H32BrNO5
MOLECULAR WEIGHT: 458.38648
SMILES: CC[NH+]1CCC2C(C1)CCCC2OC(=O)C3=CC(=C(C(=C3)OC)OC)OC.[Br-]
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Product OPENEYE NAME: (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
CAS Name: 3,4,5-trimethoxybenzoic acid (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) ester
IUPAC NAME: (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
SYSTEMATIC NAME: (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
MOLECULAR FORMULA: C21H31NO5
MOLECULAR WEIGHT: 377.47454
SMILES: CCN1CCC2C(C1)CCCC2OC(=O)C3=CC(=C(C(=C3)OC)OC)OC
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Product OPENEYE NAME: 2-cyanoethyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid 2-cyanoethyl ester
IUPAC NAME: 2-cyanoethyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-cyanoethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C7H9NO2
MOLECULAR WEIGHT: 139.15186
SMILES: CC(=C)C(=O)OCCC#N
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Product OPENEYE NAME: 12-methylbenzo[a]pyrene
CAS Name: 12-methylbenzo[a]pyrene
IUPAC NAME: 12-methylbenzo[a]pyrene
SYSTEMATIC NAME: 12-methylbenzo[a]pyrene
MOLECULAR FORMULA: C21H14
MOLECULAR WEIGHT: 266.33586
SMILES: CC1=CC2=C3C(=CC4=CC=CC=C42)C=CC5=C3C1=CC=C5
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Product OPENEYE NAME: 6-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
CAS Name: 6-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C9H8ClN5
MOLECULAR WEIGHT: 221.64632
SMILES: C1=CC(=CC=C1C2=NC(=NC(=N2)N)N)Cl
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Product OPENEYE NAME: 4,6-dibromo-1,3,5-triazin-2-amine
CAS Name: 4,6-dibromo-1,3,5-triazin-2-amine
IUPAC NAME: 4,6-dibromo-1,3,5-triazin-2-amine
SYSTEMATIC NAME: 4,6-bis(bromanyl)-1,3,5-triazin-2-amine
MOLECULAR FORMULA: C3H2Br2N4
MOLECULAR WEIGHT: 253.88278
SMILES: C1(=NC(=NC(=N1)Br)Br)N
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Product OPENEYE NAME: 1-nitrosopiperidine-2-carboxylic acid
CAS Name: 1-nitroso-2-piperidinecarboxylic acid
IUPAC NAME: 1-nitrosopiperidine-2-carboxylic acid
SYSTEMATIC NAME: 1-nitrosopiperidine-2-carboxylic acid
MOLECULAR FORMULA: C6H10N2O3
MOLECULAR WEIGHT: 158.1552
SMILES: C1CCN(C(C1)C(=O)O)N=O
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Product OPENEYE NAME: 1,1,3-trimethylcyclopentane
CAS Name: 1,1,3-trimethylcyclopentane
IUPAC NAME: 1,1,3-trimethylcyclopentane
SYSTEMATIC NAME: 1,1,3-trimethylcyclopentane
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CC1CCC(C1)(C)C
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Product OPENEYE NAME: acenaphthylen-5-amine
CAS Name: 5-acenaphthylenamine
IUPAC NAME: acenaphthylen-5-amine
SYSTEMATIC NAME: acenaphthylen-5-amine
MOLECULAR FORMULA: C12H9N
MOLECULAR WEIGHT: 167.20656
SMILES: C1=CC2=C(C=CC3=C2C(=C1)C=C3)N
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Product OPENEYE NAME: 2-bromo-4,6-dichloro-phenol
CAS Name: 2-bromo-4,6-dichlorophenol
IUPAC NAME: 2-bromo-4,6-dichlorophenol
SYSTEMATIC NAME: 2-bromanyl-4,6-bis(chloranyl)phenol
MOLECULAR FORMULA: C6H3BrCl2O
MOLECULAR WEIGHT: 241.89742
SMILES: C1=C(C=C(C(=C1Cl)O)Br)Cl
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