Product OPENEYE NAME: tetrapropylammonium hydroxide
CAS Name: tetrapropylammonium hydroxide
IUPAC NAME: tetrapropylazanium hydroxide
SYSTEMATIC NAME: tetrapropylazanium hydroxide
MOLECULAR FORMULA: C12H29NO
MOLECULAR WEIGHT: 203.36476
SMILES: CCC[N+](CCC)(CCC)CCC.[OH-]
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Product OPENEYE NAME: 2-[cyclohexyl(2-hydroxyethyl)amino]ethanol
CAS Name: 2-[cyclohexyl(2-hydroxyethyl)amino]ethanol
IUPAC NAME: 2-[cyclohexyl(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: 2-[cyclohexyl(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C10H21NO2
MOLECULAR WEIGHT: 187.27924
SMILES: C1CCC(CC1)N(CCO)CCO
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Product OPENEYE NAME: 2-ethylisoquinolin-2-ium-5-ol bromide
CAS Name: 2-ethyl-5-isoquinolin-2-iumol bromide
IUPAC NAME: 2-ethylisoquinolin-2-ium-5-ol bromide
SYSTEMATIC NAME: 2-ethylisoquinolin-2-ium-5-ol bromide
MOLECULAR FORMULA: C11H12BrNO
MOLECULAR WEIGHT: 254.12308
SMILES: CC[N+]1=CC2=C(C=C1)C(=CC=C2)O.[Br-]
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Product OPENEYE NAME: 2-ethylisoquinolin-2-ium-5-ol
CAS Name: 2-ethyl-5-isoquinolin-2-iumol
IUPAC NAME: 2-ethylisoquinolin-2-ium-5-ol
SYSTEMATIC NAME: 2-ethylisoquinolin-2-ium-5-ol
MOLECULAR FORMULA: C11H12NO+
MOLECULAR WEIGHT: 174.21908
SMILES: CC[N+]1=CC2=C(C=C1)C(=CC=C2)O
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Product OPENEYE NAME: 1-(2,2,3-trimethylcyclopent-3-en-1-yl)ethanone
CAS Name: 1-(2,2,3-trimethyl-1-cyclopent-3-enyl)ethanone
IUPAC NAME: 1-(2,2,3-trimethylcyclopent-3-en-1-yl)ethanone
SYSTEMATIC NAME: 1-(2,2,3-trimethylcyclopent-3-en-1-yl)ethanone
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: CC1=CCC(C1(C)C)C(=O)C
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Product OPENEYE NAME: 1-(2-amino-3-hydroxy-phenyl)ethanone
CAS Name: 1-(2-amino-3-hydroxyphenyl)ethanone
IUPAC NAME: 1-(2-amino-3-hydroxyphenyl)ethanone
SYSTEMATIC NAME: 1-(2-azanyl-3-oxidanyl-phenyl)ethanone
MOLECULAR FORMULA: C8H9NO2
MOLECULAR WEIGHT: 151.16256
SMILES: CC(=O)C1=C(C(=CC=C1)O)N
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Product OPENEYE NAME: [2-hydroxy-2-(4-hydroxyphenyl)ethyl]ammonium chloride
CAS Name: [2-hydroxy-2-(4-hydroxyphenyl)ethyl]ammonium chloride
IUPAC NAME: [2-hydroxy-2-(4-hydroxyphenyl)ethyl]azanium chloride
SYSTEMATIC NAME: [2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]azanium chloride
MOLECULAR FORMULA: C8H12ClNO2
MOLECULAR WEIGHT: 189.63938
SMILES: C1=CC(=CC=C1C(C[NH3+])O)O.[Cl-]
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Product OPENEYE NAME: 11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-ol
CAS Name: 11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-ol
IUPAC NAME: 11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-ol
SYSTEMATIC NAME: 11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-ol
MOLECULAR FORMULA: C19H23NO2
MOLECULAR WEIGHT: 297.39142
SMILES: CN(C)CCCC1(C2=CC=CC=C2COC3=CC=CC=C31)O
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Product OPENEYE NAME: 3-methylcyclopentane-1,2,4-trione
CAS Name: 3-methylcyclopentane-1,2,4-trione
IUPAC NAME: 3-methylcyclopentane-1,2,4-trione
SYSTEMATIC NAME: 3-methylcyclopentane-1,2,4-trione
MOLECULAR FORMULA: C6H6O3
MOLECULAR WEIGHT: 126.11004
SMILES: CC1C(=O)CC(=O)C1=O
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Product OPENEYE NAME: 1,5,8-trimethyl-1,2-dihydronaphthalene
CAS Name: 1,5,8-trimethyl-1,2-dihydronaphthalene
IUPAC NAME: 1,5,8-trimethyl-1,2-dihydronaphthalene
SYSTEMATIC NAME: 1,5,8-trimethyl-1,2-dihydronaphthalene
MOLECULAR FORMULA: C13H16
MOLECULAR WEIGHT: 172.26614
SMILES: CC1CC=CC2=C(C=CC(=C12)C)C
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Product OPENEYE NAME: 6-oxa-3$l^{6}-thiabicyclo[3.1.0]hexane 3,3-dioxide
CAS Name: 6-oxa-3$l^{6}-thiabicyclo[3.1.0]hexane 3,3-dioxide
IUPAC NAME: 6-oxa-3$l^{6}-thiabicyclo[3.1.0]hexane 3,3-dioxide
SYSTEMATIC NAME: 6-oxa-3$l^{6}-thiabicyclo[3.1.0]hexane 3,3-dioxide
MOLECULAR FORMULA: C4H6O3S
MOLECULAR WEIGHT: 134.15364
SMILES: C1C2C(O2)CS1(=O)=O
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Product OPENEYE NAME: 3-[2-(azepan-1-yl)ethyl]-2-phenyl-1H-indole
CAS Name: 3-[2-(1-azepanyl)ethyl]-2-phenyl-1H-indole
IUPAC NAME: 3-[2-(azepan-1-yl)ethyl]-2-phenyl-1H-indole
SYSTEMATIC NAME: 3-[2-(azepan-1-yl)ethyl]-2-phenyl-1H-indole
MOLECULAR FORMULA: C22H26N2
MOLECULAR WEIGHT: 318.45524
SMILES: C1CCCN(CC1)CCC2=C(NC3=CC=CC=C32)C4=CC=CC=C4
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H27IO3
MOLECULAR WEIGHT: 394.28825
SMILES: CC(C(=O)[O-])O.C1CCC2C(C1)CC3CCCCC3[I+]2
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H22I+
MOLECULAR WEIGHT: 305.21825
SMILES: C1CCC2C(C1)CC3CCCCC3[I+]2
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Product OPENEYE NAME: 5,6-diphenyl-2H-1,2,4-triazin-3-one
CAS Name: 5,6-diphenyl-2H-1,2,4-triazin-3-one
IUPAC NAME: 5,6-diphenyl-2H-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5,6-diphenyl-2H-1,2,4-triazin-3-one
MOLECULAR FORMULA: C15H11N3O
MOLECULAR WEIGHT: 249.26734
SMILES: C1=CC=C(C=C1)C2=NC(=O)NN=C2C3=CC=CC=C3
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Product OPENEYE NAME: 2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-ol bromide
CAS Name: 2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-ol bromide
IUPAC NAME: 2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-ol bromide
SYSTEMATIC NAME: 2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-ol bromide
MOLECULAR FORMULA: C11H16BrNO
MOLECULAR WEIGHT: 258.15484
SMILES: CC[NH+]1CCC2=C(C1)C=CC=C2O.[Br-]
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Product OPENEYE NAME: 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol
CAS Name: 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol
IUPAC NAME: 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol
SYSTEMATIC NAME: 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol
MOLECULAR FORMULA: C11H15NO
MOLECULAR WEIGHT: 177.2429
SMILES: CCN1CCC2=C(C1)C=CC=C2O
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Product OPENEYE NAME: (2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-yl) 3,4,5-trimethoxybenzoate bromide
CAS Name: 3,4,5-trimethoxybenzoic acid (2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-yl) ester bromide
IUPAC NAME: (2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-yl) 3,4,5-trimethoxybenzoate bromide
SYSTEMATIC NAME: (2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-yl) 3,4,5-trimethoxybenzoate bromide
MOLECULAR FORMULA: C21H26BrNO5
MOLECULAR WEIGHT: 452.33884
SMILES: CC[NH+]1CCC2=C(C1)C=CC=C2OC(=O)C3=CC(=C(C(=C3)OC)OC)OC.[Br-]
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Product OPENEYE NAME: (2-ethyl-3,4-dihydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
CAS Name: 3,4,5-trimethoxybenzoic acid (2-ethyl-3,4-dihydro-1H-isoquinolin-5-yl) ester
IUPAC NAME: (2-ethyl-3,4-dihydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
SYSTEMATIC NAME: (2-ethyl-3,4-dihydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CCN1CCC2=C(C1)C=CC=C2OC(=O)C3=CC(=C(C(=C3)OC)OC)OC
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