Product OPENEYE NAME: 2-methyl-2-pentyl-1,3-dioxolane
CAS Name: 2-methyl-2-pentyl-1,3-dioxolane
IUPAC NAME: 2-methyl-2-pentyl-1,3-dioxolane
SYSTEMATIC NAME: 2-methyl-2-pentyl-1,3-dioxolane
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: CCCCCC1(OCCO1)C
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Product OPENEYE NAME: 2-methyl-2-propyl-1,3-dioxolane
CAS Name: 2-methyl-2-propyl-1,3-dioxolane
IUPAC NAME: 2-methyl-2-propyl-1,3-dioxolane
SYSTEMATIC NAME: 2-methyl-2-propyl-1,3-dioxolane
MOLECULAR FORMULA: C7H14O2
MOLECULAR WEIGHT: 130.18486
SMILES: CCCC1(OCCO1)C
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Product OPENEYE NAME: 4-methyl-2-(trichloromethyl)-1,3-dioxolane
CAS Name: 4-methyl-2-(trichloromethyl)-1,3-dioxolane
IUPAC NAME: 4-methyl-2-(trichloromethyl)-1,3-dioxolane
SYSTEMATIC NAME: 4-methyl-2-(trichloromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C5H7Cl3O2
MOLECULAR WEIGHT: 205.46688
SMILES: CC1COC(O1)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 3-isoquinolin-2-ium-2-ylpropyl(trimethyl)ammonium dibromide
CAS Name: 3-(2-isoquinolin-2-iumyl)propyl-trimethylammonium dibromide
IUPAC NAME: 3-isoquinolin-2-ium-2-ylpropyl(trimethyl)azanium dibromide
SYSTEMATIC NAME: 3-isoquinolin-2-ium-2-ylpropyl(trimethyl)azanium dibromide
MOLECULAR FORMULA: C15H22Br2N2
MOLECULAR WEIGHT: 390.15658
SMILES: C[N+](C)(C)CCC[N+]1=CC2=CC=CC=C2C=C1.[Br-].[Br-]
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Product OPENEYE NAME: 3-isoquinolin-2-ium-2-ylpropyl(trimethyl)ammonium
CAS Name: 3-(2-isoquinolin-2-iumyl)propyl-trimethylammonium
IUPAC NAME: 3-isoquinolin-2-ium-2-ylpropyl(trimethyl)azanium
SYSTEMATIC NAME: 3-isoquinolin-2-ium-2-ylpropyl(trimethyl)azanium
MOLECULAR FORMULA: C15H22N2+2
MOLECULAR WEIGHT: 230.34858
SMILES: C[N+](C)(C)CCC[N+]1=CC2=CC=CC=C2C=C1
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Product OPENEYE NAME: 6-cyclohexylhexan-1-ol
CAS Name: 6-cyclohexyl-1-hexanol
IUPAC NAME: 6-cyclohexylhexan-1-ol
SYSTEMATIC NAME: 6-cyclohexylhexan-1-ol
MOLECULAR FORMULA: C12H24O
MOLECULAR WEIGHT: 184.31836
SMILES: C1CCC(CC1)CCCCCCO
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Product OPENEYE NAME: 2-cyclohexylidenepropanedinitrile
CAS Name: 2-cyclohexylidenepropanedinitrile
IUPAC NAME: 2-cyclohexylidenepropanedinitrile
SYSTEMATIC NAME: 2-cyclohexylidenepropanedinitrile
MOLECULAR FORMULA: C9H10N2
MOLECULAR WEIGHT: 146.1891
SMILES: C1CCC(=C(C#N)C#N)CC1
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Product OPENEYE NAME: 8,10-dioxo-9-azaspiro[5.5]undecane-7,11-dicarbonitrile
CAS Name: 8,10-dioxo-9-azaspiro[5.5]undecane-7,11-dicarbonitrile
IUPAC NAME: 8,10-dioxo-9-azaspiro[5.5]undecane-7,11-dicarbonitrile
SYSTEMATIC NAME: 8,10-bis(oxidanylidene)-9-azaspiro[5.5]undecane-7,11-dicarbonitrile
MOLECULAR FORMULA: C12H13N3O2
MOLECULAR WEIGHT: 231.25052
SMILES: C1CCC2(CC1)C(C(=O)NC(=O)C2C#N)C#N
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H26N2O2
MOLECULAR WEIGHT: 326.43264
SMILES: CCC1[C@H](N2C3CC1C4C2CC5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4O)O
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Product OPENEYE NAME: 3-phenylprop-2-en-1-amine
CAS Name: 3-phenyl-2-propen-1-amine
IUPAC NAME: 3-phenylprop-2-en-1-amine
SYSTEMATIC NAME: 3-phenylprop-2-en-1-amine
MOLECULAR FORMULA: C9H11N
MOLECULAR WEIGHT: 133.19034
SMILES: C1=CC=C(C=C1)C=CCN
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Product OPENEYE NAME: (2-methyl-2-pentyl-1,3-dioxolan-4-yl)methanol
CAS Name: (2-methyl-2-pentyl-1,3-dioxolan-4-yl)methanol
IUPAC NAME: (2-methyl-2-pentyl-1,3-dioxolan-4-yl)methanol
SYSTEMATIC NAME: (2-methyl-2-pentyl-1,3-dioxolan-4-yl)methanol
MOLECULAR FORMULA: C10H20O3
MOLECULAR WEIGHT: 188.264
SMILES: CCCCCC1(OCC(O1)CO)C
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Product OPENEYE NAME: (2-methyl-2-phenyl-1,3-dioxolan-4-yl)methanol
CAS Name: (2-methyl-2-phenyl-1,3-dioxolan-4-yl)methanol
IUPAC NAME: (2-methyl-2-phenyl-1,3-dioxolan-4-yl)methanol
SYSTEMATIC NAME: (2-methyl-2-phenyl-1,3-dioxolan-4-yl)methanol
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CC1(OCC(O1)CO)C2=CC=CC=C2
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Product OPENEYE NAME: (2-methyl-2-propyl-1,3-dioxolan-4-yl)methanol
CAS Name: (2-methyl-2-propyl-1,3-dioxolan-4-yl)methanol
IUPAC NAME: (2-methyl-2-propyl-1,3-dioxolan-4-yl)methanol
SYSTEMATIC NAME: (2-methyl-2-propyl-1,3-dioxolan-4-yl)methanol
MOLECULAR FORMULA: C8H16O3
MOLECULAR WEIGHT: 160.21084
SMILES: CCCC1(OCC(O1)CO)C
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Product OPENEYE NAME: [2-methyl-2-(2-thienyl)-1,3-dioxolan-4-yl]methanol
CAS Name: (2-methyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)methanol
IUPAC NAME: (2-methyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)methanol
SYSTEMATIC NAME: (2-methyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)methanol
MOLECULAR FORMULA: C9H12O3S
MOLECULAR WEIGHT: 200.25478
SMILES: CC1(OCC(O1)CO)C2=CC=CS2
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Product OPENEYE NAME: 4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane
CAS Name: 4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane
IUPAC NAME: 4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane
SYSTEMATIC NAME: 4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane
MOLECULAR FORMULA: C6H11ClO2
MOLECULAR WEIGHT: 150.60334
SMILES: CC1(OCC(O1)CCl)C
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Product OPENEYE NAME: 4-(chloromethyl)-2-(trichloromethyl)-1,3-dioxolane
CAS Name: 4-(chloromethyl)-2-(trichloromethyl)-1,3-dioxolane
IUPAC NAME: 4-(chloromethyl)-2-(trichloromethyl)-1,3-dioxolane
SYSTEMATIC NAME: 4-(chloromethyl)-2-(trichloromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C5H6Cl4O2
MOLECULAR WEIGHT: 239.91194
SMILES: C1C(OC(O1)C(Cl)(Cl)Cl)CCl
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Product OPENEYE NAME: 2-amino-5-phenyl-phenol
CAS Name: 2-amino-5-phenylphenol
IUPAC NAME: 2-amino-5-phenylphenol
SYSTEMATIC NAME: 2-azanyl-5-phenyl-phenol
MOLECULAR FORMULA: C12H11NO
MOLECULAR WEIGHT: 185.22184
SMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)N)O
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Product OPENEYE NAME: 1-ethyl-3-phenyl-azetidine
CAS Name: 1-ethyl-3-phenylazetidine
IUPAC NAME: 1-ethyl-3-phenylazetidine
SYSTEMATIC NAME: 1-ethyl-3-phenyl-azetidine
MOLECULAR FORMULA: C11H15N
MOLECULAR WEIGHT: 161.2435
SMILES: CCN1CC(C1)C2=CC=CC=C2
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Product OPENEYE NAME: 1-(4-chlorophenyl)-2-[4-[2-(diethylamino)ethylamino]-6-methyl-pyrimidin-2-yl]guanidine
CAS Name: 1-(4-chlorophenyl)-2-[4-[2-(diethylamino)ethylamino]-6-methyl-2-pyrimidinyl]guanidine
IUPAC NAME: 1-(4-chlorophenyl)-2-[4-[2-(diethylamino)ethylamino]-6-methylpyrimidin-2-yl]guanidine
SYSTEMATIC NAME: 1-(4-chlorophenyl)-2-[4-[2-(diethylamino)ethylamino]-6-methyl-pyrimidin-2-yl]guanidine
MOLECULAR FORMULA: C18H26ClN7
MOLECULAR WEIGHT: 375.89894
SMILES: CCN(CC)CCNC1=NC(=NC(=C1)C)N=C(N)NC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-phenyl-2-(p-tolylazo)butane-1,3-dione
CAS Name: 2-(4-methylphenyl)azo-1-phenylbutane-1,3-dione
IUPAC NAME: 2-[(4-methylphenyl)diazenyl]-1-phenylbutane-1,3-dione
SYSTEMATIC NAME: 2-[(4-methylphenyl)diazenyl]-1-phenyl-butane-1,3-dione
MOLECULAR FORMULA: C17H16N2O2
MOLECULAR WEIGHT: 280.32114
SMILES: CC1=CC=C(C=C1)N=NC(C(=O)C)C(=O)C2=CC=CC=C2
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