Product OPENEYE NAME: N-phenylbutanamide
CAS Name: N-phenylbutanamide
IUPAC NAME: N-phenylbutanamide
SYSTEMATIC NAME: N-phenylbutanamide
MOLECULAR FORMULA: C10H13NO
MOLECULAR WEIGHT: 163.21632
SMILES: CCCC(=O)NC1=CC=CC=C1
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Product OPENEYE NAME: 9-azaspiro[5.5]undecane-8,10-dione
CAS Name: 9-azaspiro[5.5]undecane-8,10-dione
IUPAC NAME: 9-azaspiro[5.5]undecane-8,10-dione
SYSTEMATIC NAME: 9-azaspiro[5.5]undecane-8,10-dione
MOLECULAR FORMULA: C10H15NO2
MOLECULAR WEIGHT: 181.2316
SMILES: C1CCC2(CC1)CC(=O)NC(=O)C2
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Product OPENEYE NAME: diethyl-(3-hydroxyphenyl)-methyl-ammonium chloride
CAS Name: diethyl-(3-hydroxyphenyl)-methylammonium chloride
IUPAC NAME: diethyl-(3-hydroxyphenyl)-methylazanium chloride
SYSTEMATIC NAME: diethyl-(3-hydroxyphenyl)-methyl-azanium chloride
MOLECULAR FORMULA: C11H18ClNO
MOLECULAR WEIGHT: 215.71972
SMILES: CC[N+](C)(CC)C1=CC(=CC=C1)O.[Cl-]
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Product OPENEYE NAME: diethyl-(3-hydroxyphenyl)-methyl-ammonium
CAS Name: diethyl-(3-hydroxyphenyl)-methylammonium
IUPAC NAME: diethyl-(3-hydroxyphenyl)-methylazanium
SYSTEMATIC NAME: diethyl-(3-hydroxyphenyl)-methyl-azanium
MOLECULAR FORMULA: C11H18NO+
MOLECULAR WEIGHT: 180.26672
SMILES: CC[N+](C)(CC)C1=CC(=CC=C1)O
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Product OPENEYE NAME: 4-cyclohexylphenol
CAS Name: 4-cyclohexylphenol
IUPAC NAME: 4-cyclohexylphenol
SYSTEMATIC NAME: 4-cyclohexylphenol
MOLECULAR FORMULA: C12H16O
MOLECULAR WEIGHT: 176.25484
SMILES: C1CCC(CC1)C2=CC=C(C=C2)O
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Product OPENEYE NAME: 1-(3,4-dimethoxyphenyl)ethanone
CAS Name: 1-(3,4-dimethoxyphenyl)ethanone
IUPAC NAME: 1-(3,4-dimethoxyphenyl)ethanone
SYSTEMATIC NAME: 1-(3,4-dimethoxyphenyl)ethanone
MOLECULAR FORMULA: C10H12O3
MOLECULAR WEIGHT: 180.20048
SMILES: CC(=O)C1=CC(=C(C=C1)OC)OC
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Product OPENEYE NAME: 1,2,3,4-tetrahydroisoquinolin-2-ium-2-carboxamidine bromide
CAS Name: 1,2,3,4-tetrahydroisoquinolin-2-ium-2-carboximidamide bromide
IUPAC NAME: 1,2,3,4-tetrahydroisoquinolin-2-ium-2-carboximidamide bromide
SYSTEMATIC NAME: 1,2,3,4-tetrahydroisoquinolin-2-ium-2-carboximidamide bromide
MOLECULAR FORMULA: C10H14BrN3
MOLECULAR WEIGHT: 256.14226
SMILES: C1C[NH+](CC2=CC=CC=C21)C(=N)N.[Br-]
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Product OPENEYE NAME: 1-(3-azabicyclo[3.2.2]nonan-3-yl)-2-chloro-ethanone
CAS Name: 1-(3-azabicyclo[3.2.2]nonan-3-yl)-2-chloroethanone
IUPAC NAME: 1-(3-azabicyclo[3.2.2]nonan-3-yl)-2-chloroethanone
SYSTEMATIC NAME: 1-(3-azabicyclo[3.2.2]nonan-3-yl)-2-chloranyl-ethanone
MOLECULAR FORMULA: C10H16ClNO
MOLECULAR WEIGHT: 201.69314
SMILES: C1CC2CCC1CN(C2)C(=O)CCl
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Product OPENEYE NAME: 3,5-dimethoxybenzoic acid
CAS Name: 3,5-dimethoxybenzoic acid
IUPAC NAME: 3,5-dimethoxybenzoic acid
SYSTEMATIC NAME: 3,5-dimethoxybenzoic acid
MOLECULAR FORMULA: C9H10O4
MOLECULAR WEIGHT: 182.1733
SMILES: COC1=CC(=CC(=C1)C(=O)O)OC
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Product OPENEYE NAME: phenylselanylbenzene
CAS Name: (phenylseleno)benzene
IUPAC NAME: phenylselanylbenzene
SYSTEMATIC NAME: phenylselanylbenzene
MOLECULAR FORMULA: C12H10Se
MOLECULAR WEIGHT: 233.1678
SMILES: C1=CC=C(C=C1)[Se]C2=CC=CC=C2
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Product OPENEYE NAME: 6-hydroxy-4,4,7a-trimethyl-6,7-dihydro-5H-benzofuran-2-one
CAS Name: 6-hydroxy-4,4,7a-trimethyl-6,7-dihydro-5H-benzofuran-2-one
IUPAC NAME: 6-hydroxy-4,4,7a-trimethyl-6,7-dihydro-5H-1-benzofuran-2-one
SYSTEMATIC NAME: 4,4,7a-trimethyl-6-oxidanyl-6,7-dihydro-5H-1-benzofuran-2-one
MOLECULAR FORMULA: C11H16O3
MOLECULAR WEIGHT: 196.24294
SMILES: CC1(CC(CC2(C1=CC(=O)O2)C)O)C
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Product OPENEYE NAME: 3-(1-nitroso-2-piperidyl)pyridine
CAS Name: 3-(1-nitroso-2-piperidinyl)pyridine
IUPAC NAME: 3-(1-nitrosopiperidin-2-yl)pyridine
SYSTEMATIC NAME: 3-(1-nitrosopiperidin-2-yl)pyridine
MOLECULAR FORMULA: C10H13N3O
MOLECULAR WEIGHT: 191.22972
SMILES: C1CCN(C(C1)C2=CN=CC=C2)N=O
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Product OPENEYE NAME: 2-bromo-9H-fluorene
CAS Name: 2-bromo-9H-fluorene
IUPAC NAME: 2-bromo-9H-fluorene
SYSTEMATIC NAME: 2-bromanyl-9H-fluorene
MOLECULAR FORMULA: C13H9Br
MOLECULAR WEIGHT: 245.11456
SMILES: C1C2=CC=CC=C2C3=C1C=C(C=C3)Br
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Product OPENEYE NAME: S-ethyl N-cyclohexyl-N-ethyl-carbamothioate
CAS Name: N-cyclohexyl-N-ethylcarbamothioic acid S-ethyl ester
IUPAC NAME: S-ethyl N-cyclohexyl-N-ethylcarbamothioate
SYSTEMATIC NAME: S-ethyl N-cyclohexyl-N-ethyl-carbamothioate
MOLECULAR FORMULA: C11H21NOS
MOLECULAR WEIGHT: 215.35554
SMILES: CCN(C1CCCCC1)C(=O)SCC
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Product OPENEYE NAME: 4-methyl-2-(4-methyl-2-pyridyl)pyridine
CAS Name: 4-methyl-2-(4-methyl-2-pyridinyl)pyridine
IUPAC NAME: 4-methyl-2-(4-methylpyridin-2-yl)pyridine
SYSTEMATIC NAME: 4-methyl-2-(4-methylpyridin-2-yl)pyridine
MOLECULAR FORMULA: C12H12N2
MOLECULAR WEIGHT: 184.23708
SMILES: CC1=CC(=NC=C1)C2=NC=CC(=C2)C
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Product OPENEYE NAME: 2-butylnaphthalene
CAS Name: 2-butylnaphthalene
IUPAC NAME: 2-butylnaphthalene
SYSTEMATIC NAME: 2-butylnaphthalene
MOLECULAR FORMULA: C14H16
MOLECULAR WEIGHT: 184.27684
SMILES: CCCCC1=CC2=CC=CC=C2C=C1
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Product OPENEYE NAME: 3-(4-hydroxy-3-methoxy-phenyl)propanoic acid
CAS Name: 3-(4-hydroxy-3-methoxyphenyl)propanoic acid
IUPAC NAME: 3-(4-hydroxy-3-methoxyphenyl)propanoic acid
SYSTEMATIC NAME: 3-(3-methoxy-4-oxidanyl-phenyl)propanoic acid
MOLECULAR FORMULA: C10H12O4
MOLECULAR WEIGHT: 196.19988
SMILES: COC1=C(C=CC(=C1)CCC(=O)O)O
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