Product OPENEYE NAME: [2-(2-fluoroethoxy)-2-oxo-ethyl]ammonium chloride
CAS Name: [2-(2-fluoroethoxy)-2-oxoethyl]ammonium chloride
IUPAC NAME: [2-(2-fluoroethoxy)-2-oxoethyl]azanium chloride
SYSTEMATIC NAME: [2-(2-fluoranylethoxy)-2-oxidanylidene-ethyl]azanium chloride
MOLECULAR FORMULA: C4H9ClFNO2
MOLECULAR WEIGHT: 157.571163
SMILES: C(CF)OC(=O)C[NH3+].[Cl-]
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Product OPENEYE NAME: 2-fluoroethyl 2-aminoacetate
CAS Name: 2-aminoacetic acid 2-fluoroethyl ester
IUPAC NAME: 2-fluoroethyl 2-aminoacetate
SYSTEMATIC NAME: 2-fluoranylethyl 2-azanylethanoate
MOLECULAR FORMULA: C4H8FNO2
MOLECULAR WEIGHT: 121.110223
SMILES: C(CF)OC(=O)CN
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Product OPENEYE NAME: 2-amino-3-chloro-naphthalene-1,4-dione
CAS Name: 2-amino-3-chloronaphthalene-1,4-dione
IUPAC NAME: 2-amino-3-chloronaphthalene-1,4-dione
SYSTEMATIC NAME: 2-azanyl-3-chloranyl-naphthalene-1,4-dione
MOLECULAR FORMULA: C10H6ClNO2
MOLECULAR WEIGHT: 207.61314
SMILES: C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)N
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Product OPENEYE NAME: 1-[[4-amino-6-[(2,2,2-trichloro-1-hydroxy-ethyl)amino]-1,3,5-triazin-2-yl]amino]-2,2,2-trichloro-ethanol
CAS Name: 1-[[4-amino-6-[(2,2,2-trichloro-1-hydroxyethyl)amino]-1,3,5-triazin-2-yl]amino]-2,2,2-trichloroethanol
IUPAC NAME: 1-[[4-amino-6-[(2,2,2-trichloro-1-hydroxyethyl)amino]-1,3,5-triazin-2-yl]amino]-2,2,2-trichloroethanol
SYSTEMATIC NAME: 1-[[4-azanyl-6-[[2,2,2-tris(chloranyl)-1-oxidanyl-ethyl]amino]-1,3,5-triazin-2-yl]amino]-2,2,2-tris(chloranyl)ethanol
MOLECULAR FORMULA: C7H8Cl6N6O2
MOLECULAR WEIGHT: 420.89542
SMILES: C1(=NC(=NC(=N1)NC(C(Cl)(Cl)Cl)O)NC(C(Cl)(Cl)Cl)O)N
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Product OPENEYE NAME: 1,10-bis(aziridin-1-yl)decane-1,10-dione
CAS Name: 1,10-bis(1-aziridinyl)decane-1,10-dione
IUPAC NAME: 1,10-bis(aziridin-1-yl)decane-1,10-dione
SYSTEMATIC NAME: 1,10-bis(aziridin-1-yl)decane-1,10-dione
MOLECULAR FORMULA: C14H24N2O2
MOLECULAR WEIGHT: 252.35256
SMILES: C1CN1C(=O)CCCCCCCCC(=O)N2CC2
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Product OPENEYE NAME: 4-methylpentadecane
CAS Name: 4-methylpentadecane
IUPAC NAME: 4-methylpentadecane
SYSTEMATIC NAME: 4-methylpentadecane
MOLECULAR FORMULA: C16H34
MOLECULAR WEIGHT: 226.44116
SMILES: CCCCCCCCCCCC(C)CCC
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Product OPENEYE NAME: [5-fluoro-2-[(2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]phenyl]ammonium dichloride
CAS Name: [5-fluoro-2-[(2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]phenyl]ammonium dichloride
IUPAC NAME: [5-fluoro-2-[(2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]phenyl]azanium dichloride
SYSTEMATIC NAME: [5-fluoranyl-2-[(2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl)methyl]phenyl]azanium dichloride
MOLECULAR FORMULA: C17H21Cl2FN2
MOLECULAR WEIGHT: 343.266443
SMILES: C[NH+]1CCC2=CC=CC=C2C1CC3=C(C=C(C=C3)F)[NH3+].[Cl-].[Cl-]
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Product OPENEYE NAME: 5-fluoro-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]aniline
CAS Name: 5-fluoro-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]aniline
IUPAC NAME: 5-fluoro-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]aniline
SYSTEMATIC NAME: 5-fluoranyl-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]aniline
MOLECULAR FORMULA: C17H19FN2
MOLECULAR WEIGHT: 270.344563
SMILES: CN1CCC2=CC=CC=C2C1CC3=C(C=C(C=C3)F)N
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Product OPENEYE NAME: prop-2-ynylidenecyclohexane
CAS Name: prop-2-ynylidenecyclohexane
IUPAC NAME: prop-2-ynylidenecyclohexane
SYSTEMATIC NAME: prop-2-ynylidenecyclohexane
MOLECULAR FORMULA: C9H12
MOLECULAR WEIGHT: 120.19158
SMILES: C#CC=C1CCCCC1
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Product OPENEYE NAME: 3-ethoxypropanal
CAS Name: 3-ethoxypropanal
IUPAC NAME: 3-ethoxypropanal
SYSTEMATIC NAME: 3-ethoxypropanal
MOLECULAR FORMULA: C5H10O2
MOLECULAR WEIGHT: 102.1317
SMILES: CCOCCC=O
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Product OPENEYE NAME: 2-propoxyethanol
CAS Name: 2-propoxyethanol
IUPAC NAME: 2-propoxyethanol
SYSTEMATIC NAME: 2-propoxyethanol
MOLECULAR FORMULA: C5H12O2
MOLECULAR WEIGHT: 104.14758
SMILES: CCCOCCO
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Product OPENEYE NAME: 5,8-dihydroxy-2,7-dimethoxy-naphthalene-1,4-dione
CAS Name: 5,8-dihydroxy-2,7-dimethoxynaphthalene-1,4-dione
IUPAC NAME: 5,8-dihydroxy-2,7-dimethoxynaphthalene-1,4-dione
SYSTEMATIC NAME: 2,7-dimethoxy-5,8-bis(oxidanyl)naphthalene-1,4-dione
MOLECULAR FORMULA: C12H10O6
MOLECULAR WEIGHT: 250.2042
SMILES: COC1=CC(=O)C2=C(C1=O)C(=C(C=C2O)OC)O
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Product OPENEYE NAME: 4-(dimethylamino)-2-methyl-2-phenyl-butanenitrile
CAS Name: 4-(dimethylamino)-2-methyl-2-phenylbutanenitrile
IUPAC NAME: 4-(dimethylamino)-2-methyl-2-phenylbutanenitrile
SYSTEMATIC NAME: 4-(dimethylamino)-2-methyl-2-phenyl-butanenitrile
MOLECULAR FORMULA: C13H18N2
MOLECULAR WEIGHT: 202.29542
SMILES: CC(CCN(C)C)(C#N)C1=CC=CC=C1
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Product OPENEYE NAME: 4-(dimethylamino)-2-ethyl-2-phenyl-butanenitrile
CAS Name: 4-(dimethylamino)-2-ethyl-2-phenylbutanenitrile
IUPAC NAME: 4-(dimethylamino)-2-ethyl-2-phenylbutanenitrile
SYSTEMATIC NAME: 4-(dimethylamino)-2-ethyl-2-phenyl-butanenitrile
MOLECULAR FORMULA: C14H20N2
MOLECULAR WEIGHT: 216.322
SMILES: CCC(CCN(C)C)(C#N)C1=CC=CC=C1
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Product OPENEYE NAME: 2-[2-(dimethylamino)ethyl]-3-methyl-2-phenyl-butanenitrile
CAS Name: 2-[2-(dimethylamino)ethyl]-3-methyl-2-phenylbutanenitrile
IUPAC NAME: 2-[2-(dimethylamino)ethyl]-3-methyl-2-phenylbutanenitrile
SYSTEMATIC NAME: 2-[2-(dimethylamino)ethyl]-3-methyl-2-phenyl-butanenitrile
MOLECULAR FORMULA: C15H22N2
MOLECULAR WEIGHT: 230.34858
SMILES: CC(C)C(CCN(C)C)(C#N)C1=CC=CC=C1
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Product OPENEYE NAME: 4-(dimethylamino)-2-[2-(dimethylamino)ethyl]-2-phenyl-butanenitrile
CAS Name: 4-(dimethylamino)-2-[2-(dimethylamino)ethyl]-2-phenylbutanenitrile
IUPAC NAME: 4-(dimethylamino)-2-[2-(dimethylamino)ethyl]-2-phenylbutanenitrile
SYSTEMATIC NAME: 4-(dimethylamino)-2-[2-(dimethylamino)ethyl]-2-phenyl-butanenitrile
MOLECULAR FORMULA: C16H25N3
MOLECULAR WEIGHT: 259.3898
SMILES: CN(C)CCC(CCN(C)C)(C#N)C1=CC=CC=C1
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Product OPENEYE NAME: 2-methyl-2-phenyl-4-(1-piperidyl)butanenitrile
CAS Name: 2-methyl-2-phenyl-4-(1-piperidinyl)butanenitrile
IUPAC NAME: 2-methyl-2-phenyl-4-piperidin-1-ylbutanenitrile
SYSTEMATIC NAME: 2-methyl-2-phenyl-4-piperidin-1-yl-butanenitrile
MOLECULAR FORMULA: C16H22N2
MOLECULAR WEIGHT: 242.35928
SMILES: CC(CCN1CCCCC1)(C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 2-ethyl-2-phenyl-4-(1-piperidyl)butanenitrile
CAS Name: 2-ethyl-2-phenyl-4-(1-piperidinyl)butanenitrile
IUPAC NAME: 2-ethyl-2-phenyl-4-piperidin-1-ylbutanenitrile
SYSTEMATIC NAME: 2-ethyl-2-phenyl-4-piperidin-1-yl-butanenitrile
MOLECULAR FORMULA: C17H24N2
MOLECULAR WEIGHT: 256.38586
SMILES: CCC(CCN1CCCCC1)(C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 3-methyl-2-phenyl-2-[2-(1-piperidyl)ethyl]butanenitrile
CAS Name: 3-methyl-2-phenyl-2-[2-(1-piperidinyl)ethyl]butanenitrile
IUPAC NAME: 3-methyl-2-phenyl-2-(2-piperidin-1-ylethyl)butanenitrile
SYSTEMATIC NAME: 3-methyl-2-phenyl-2-(2-piperidin-1-ylethyl)butanenitrile
MOLECULAR FORMULA: C18H26N2
MOLECULAR WEIGHT: 270.41244
SMILES: CC(C)C(CCN1CCCCC1)(C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 2-ethyl-4-morpholino-2-phenyl-butanenitrile
CAS Name: 2-ethyl-4-(4-morpholinyl)-2-phenylbutanenitrile
IUPAC NAME: 2-ethyl-4-morpholin-4-yl-2-phenylbutanenitrile
SYSTEMATIC NAME: 2-ethyl-4-morpholin-4-yl-2-phenyl-butanenitrile
MOLECULAR FORMULA: C16H22N2O
MOLECULAR WEIGHT: 258.35868
SMILES: CCC(CCN1CCOCC1)(C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 4-(dimethylamino)-2-(1-naphthyl)butanenitrile
CAS Name: 4-(dimethylamino)-2-(1-naphthalenyl)butanenitrile
IUPAC NAME: 4-(dimethylamino)-2-naphthalen-1-ylbutanenitrile
SYSTEMATIC NAME: 4-(dimethylamino)-2-naphthalen-1-yl-butanenitrile
MOLECULAR FORMULA: C16H18N2
MOLECULAR WEIGHT: 238.32752
SMILES: CN(C)CCC(C#N)C1=CC=CC2=CC=CC=C21
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