Product OPENEYE NAME: (2,2,6-trimethyl-4-piperidyl) benzoate
CAS Name: benzoic acid (2,2,6-trimethyl-4-piperidinyl) ester
IUPAC NAME: (2,2,6-trimethylpiperidin-4-yl) benzoate
SYSTEMATIC NAME: (2,2,6-trimethylpiperidin-4-yl) benzoate
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: CC1CC(CC(N1)(C)C)OC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: N2-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
CAS Name: N2-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
IUPAC NAME: 2-N-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2-(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C9H8ClN5
MOLECULAR WEIGHT: 221.64632
SMILES: C1=CC(=CC=C1NC2=NC=NC(=N2)N)Cl
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Product OPENEYE NAME: 4-methoxy-6-[2-(4-methoxyphenyl)vinyl]pyran-2-one
CAS Name: 4-methoxy-6-[2-(4-methoxyphenyl)ethenyl]-2-pyranone
IUPAC NAME: 4-methoxy-6-[2-(4-methoxyphenyl)ethenyl]pyran-2-one
SYSTEMATIC NAME: 4-methoxy-6-[2-(4-methoxyphenyl)ethenyl]pyran-2-one
MOLECULAR FORMULA: C15H14O4
MOLECULAR WEIGHT: 258.26926
SMILES: COC1=CC=C(C=C1)C=CC2=CC(=CC(=O)O2)OC
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Product OPENEYE NAME: 4-methoxy-2-styryl-2,3-dihydropyran-6-one
CAS Name: 4-methoxy-2-(2-phenylethenyl)-2,3-dihydropyran-6-one
IUPAC NAME: 4-methoxy-2-(2-phenylethenyl)-2,3-dihydropyran-6-one
SYSTEMATIC NAME: 4-methoxy-2-(2-phenylethenyl)-2,3-dihydropyran-6-one
MOLECULAR FORMULA: C14H14O3
MOLECULAR WEIGHT: 230.25916
SMILES: COC1=CC(=O)OC(C1)C=CC2=CC=CC=C2
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Product OPENEYE NAME: 5-pentylbenzene-1,3-diol
CAS Name: 5-pentylbenzene-1,3-diol
IUPAC NAME: 5-pentylbenzene-1,3-diol
SYSTEMATIC NAME: 5-pentylbenzene-1,3-diol
MOLECULAR FORMULA: C11H16O2
MOLECULAR WEIGHT: 180.24354
SMILES: CCCCCC1=CC(=CC(=C1)O)O
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Product OPENEYE NAME: 2-anilino-2-oxo-acetic acid
CAS Name: 2-anilino-2-oxoacetic acid
IUPAC NAME: 2-anilino-2-oxoacetic acid
SYSTEMATIC NAME: 2-oxidanylidene-2-phenylazanyl-ethanoic acid
MOLECULAR FORMULA: C8H7NO3
MOLECULAR WEIGHT: 165.14608
SMILES: C1=CC=C(C=C1)NC(=O)C(=O)O
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Product OPENEYE NAME: 4-(4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one
CAS Name: 4-(4-hydroxyphenyl)imino-1-cyclohexa-2,5-dienone
IUPAC NAME: 4-(4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C12H9NO2
MOLECULAR WEIGHT: 199.20536
SMILES: C1=CC(=O)C=CC1=NC2=CC=C(C=C2)O
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Product OPENEYE NAME: 2-anilino-2-oxo-ethanethiolate; gold(1+)
CAS Name: 2-anilino-2-oxoethanethiolate; gold(1+)
IUPAC NAME: 2-anilino-2-oxoethanethiolate; gold(1+)
SYSTEMATIC NAME: gold(1+); 2-oxidanylidene-2-phenylazanyl-ethanethiolate
MOLECULAR FORMULA: C8H8AuNOS
MOLECULAR WEIGHT: 363.18677
SMILES: C1=CC=C(C=C1)NC(=O)C[S-].[Au+]
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Product OPENEYE NAME: N-phenyl-2-sulfanyl-acetamide
CAS Name: 2-mercapto-N-phenylacetamide
IUPAC NAME: N-phenyl-2-sulfanylacetamide
SYSTEMATIC NAME: N-phenyl-2-sulfanyl-ethanamide
MOLECULAR FORMULA: C8H9NOS
MOLECULAR WEIGHT: 167.22816
SMILES: C1=CC=C(C=C1)NC(=O)CS
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Product OPENEYE NAME: 3,5-dimethoxyphenol
CAS Name: 3,5-dimethoxyphenol
IUPAC NAME: 3,5-dimethoxyphenol
SYSTEMATIC NAME: 3,5-dimethoxyphenol
MOLECULAR FORMULA: C8H10O3
MOLECULAR WEIGHT: 154.1632
SMILES: COC1=CC(=CC(=C1)O)OC
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Product OPENEYE NAME: N-(4-aminobutyl)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enamide
CAS Name: N-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)-2-propenamide
IUPAC NAME: N-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
SYSTEMATIC NAME: N-(4-azanylbutyl)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide
MOLECULAR FORMULA: C14H20N2O3
MOLECULAR WEIGHT: 264.3202
SMILES: COC1=C(C=CC(=C1)C=CC(=O)NCCCCN)O
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Product OPENEYE NAME: 2-(3-hydroxyphenyl)ethyl-trimethyl-ammonium hydroxide
CAS Name: 2-(3-hydroxyphenyl)ethyl-trimethylammonium hydroxide
IUPAC NAME: 2-(3-hydroxyphenyl)ethyl-trimethylazanium hydroxide
SYSTEMATIC NAME: 2-(3-hydroxyphenyl)ethyl-trimethyl-azanium hydroxide
MOLECULAR FORMULA: C11H19NO2
MOLECULAR WEIGHT: 197.27406
SMILES: C[N+](C)(C)CCC1=CC(=CC=C1)O.[OH-]
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Product OPENEYE NAME: 2-(3-hydroxyphenyl)ethyl-trimethyl-ammonium
CAS Name: 2-(3-hydroxyphenyl)ethyl-trimethylammonium
IUPAC NAME: 2-(3-hydroxyphenyl)ethyl-trimethylazanium
SYSTEMATIC NAME: 2-(3-hydroxyphenyl)ethyl-trimethyl-azanium
MOLECULAR FORMULA: C11H18NO+
MOLECULAR WEIGHT: 180.26672
SMILES: C[N+](C)(C)CCC1=CC(=CC=C1)O
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Product OPENEYE NAME: benzyl carbonochloridate
CAS Name: carbonochloridic acid (phenylmethyl) ester
IUPAC NAME: benzyl carbonochloridate
SYSTEMATIC NAME: (phenylmethyl) carbonochloridate
MOLECULAR FORMULA: C8H7ClO2
MOLECULAR WEIGHT: 170.59298
SMILES: C1=CC=C(C=C1)COC(=O)Cl
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Product OPENEYE NAME: bis(4-methoxyphenyl)diazene
CAS Name: bis(4-methoxyphenyl)diazene
IUPAC NAME: bis(4-methoxyphenyl)diazene
SYSTEMATIC NAME: bis(4-methoxyphenyl)diazene
MOLECULAR FORMULA: C14H14N2O2
MOLECULAR WEIGHT: 242.27316
SMILES: COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC
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Product OPENEYE NAME: bis-p-tolyldiazene
CAS Name: bis(4-methylphenyl)diazene
IUPAC NAME: bis(4-methylphenyl)diazene
SYSTEMATIC NAME: bis(4-methylphenyl)diazene
MOLECULAR FORMULA: C14H14N2
MOLECULAR WEIGHT: 210.27436
SMILES: CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C
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Product OPENEYE NAME: 2-phenylethynylbenzene
CAS Name: 2-phenylethynylbenzene
IUPAC NAME: 2-phenylethynylbenzene
SYSTEMATIC NAME: 2-phenylethynylbenzene
MOLECULAR FORMULA: C14H10
MOLECULAR WEIGHT: 178.2292
SMILES: C1=CC=C(C=C1)C#CC2=CC=CC=C2
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Product OPENEYE NAME: N-benzyl-3-chloro-propanamide
CAS Name: 3-chloro-N-(phenylmethyl)propanamide
IUPAC NAME: N-benzyl-3-chloropropanamide
SYSTEMATIC NAME: 3-chloranyl-N-(phenylmethyl)propanamide
MOLECULAR FORMULA: C10H12ClNO
MOLECULAR WEIGHT: 197.66138
SMILES: C1=CC=C(C=C1)CNC(=O)CCCl
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Product OPENEYE NAME: phenylcarbamic acid
CAS Name: phenylcarbamic acid
IUPAC NAME: phenylcarbamic acid
SYSTEMATIC NAME: phenylcarbamic acid
MOLECULAR FORMULA: C7H7NO2
MOLECULAR WEIGHT: 137.13598
SMILES: C1=CC=C(C=C1)NC(=O)O
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