CAS RN: 612-40-8
CAS Name: 2-[(E)-2-carboxyethenyl]benzoic acid
OPENEYE Name: 2-[(E)-2-carboxyvinyl]benzoic acid
IUPAC Name: 2-[(E)-2-carboxyethenyl]benzoic acid
SYSTEMATIC NAME: 2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]benzoic acid
MOLECULAR FORMULA: C10H8O4
MOLECULAR WEIGHT: 192.16812
SMILES: C1=CC=C(C(=C1)/C=C/C(=O)O)C(=O)O
Structure:
CAS RN: 7534-94-3
CAS Name: 2-methyl-2-propenoic acid [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester
OPENEYE Name: [(1R,2R,4R)-1,7,7-trimethylnorbornan-2-yl] 2-methylprop-2-enoate
IUPAC Name: [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
SYSTEMATIC NAME: [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
MOLECULAR FORMULA: C14H22O2
MOLECULAR WEIGHT: 222.32328
SMILES: CC(=C)C(=O)O[C@@H]1C[C@H]2CC[C@@]1(C2(C)C)C
Structure:
CAS RN: 28854-39-9
CAS Name: 2-methyl-2-propenoic acid [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester
OPENEYE Name: [(1R,2R,4R)-1,7,7-trimethylnorbornan-2-yl] 2-methylprop-2-enoate
IUPAC Name: [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
SYSTEMATIC NAME: [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
MOLECULAR FORMULA: C14H22O2
MOLECULAR WEIGHT: 222.32328
SMILES: CC(=C)C(=O)O[C@@H]1C[C@H]2CC[C@@]1(C2(C)C)C
Structure:
CAS RN: 64114-51-8
CAS Name: 2-methyl-2-propenoic acid [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester
OPENEYE Name: [(1R,2R,4R)-1,7,7-trimethylnorbornan-2-yl] 2-methylprop-2-enoate
IUPAC Name: [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
SYSTEMATIC NAME: [(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
MOLECULAR FORMULA: C14H22O2
MOLECULAR WEIGHT: 222.32328
SMILES: CC(=C)C(=O)O[C@@H]1C[C@H]2CC[C@@]1(C2(C)C)C
Structure:
CAS RN: 1070-66-2
CAS Name: 2-methyl-2-propenoic acid [(2R)-2-oxiranyl]methyl ester
OPENEYE Name: [(2R)-oxiran-2-yl]methyl 2-methylprop-2-enoate
IUPAC Name: [(2R)-oxiran-2-yl]methyl 2-methylprop-2-enoate
SYSTEMATIC NAME: [(2R)-oxiran-2-yl]methyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C7H10O3
MOLECULAR WEIGHT: 142.1525
SMILES: CC(=C)C(=O)OC[C@H]1CO1
Structure:
CAS RN: 34137-61-6
CAS Name: (1S,4R,5R)-1',1'-dichloro-6,6-dimethylspiro[bicyclo[3.1.1]heptane-4,2'-cyclopropane]
OPENEYE Name: (1'R,2R,5'S)-1,1-dichloro-6',6'-dimethyl-spiro[cyclopropane-2,2'-norpinane]
IUPAC Name: (1S,4R,5R)-1',1'-dichloro-6,6-dimethylspiro[bicyclo[3.1.1]heptane-4,2'-cyclopropane]
SYSTEMATIC NAME: (1S,4R,5R)-1',1'-bis(chloranyl)-6,6-dimethyl-spiro[bicyclo[3.1.1]heptane-4,2'-cyclopropane]
MOLECULAR FORMULA: C11H16Cl2
MOLECULAR WEIGHT: 219.15074
SMILES: CC1([C@H]2CC[C@]3([C@@H]1C2)CC3(Cl)Cl)C
Structure:
CAS RN: 55635-68-2
CAS Name: 3,5,6-trimethyl-N-propan-2-yl-2-imidazo[4,5-b]pyrazinamine
OPENEYE Name: N-isopropyl-3,5,6-trimethyl-imidazo[4,5-b]pyrazin-2-amine
IUPAC Name: 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine
SYSTEMATIC NAME: 3,5,6-trimethyl-N-propan-2-yl-imidazo[4,5-b]pyrazin-2-amine
MOLECULAR FORMULA: C11H17N5
MOLECULAR WEIGHT: 219.28618
SMILES: CC1=C(N=C2C(=N1)N=C(N2C)NC(C)C)C
Structure:
CAS RN: 13557-98-7
CAS Name: 1-(3-chloro-2-methylphenyl)-3-phenylthiourea
OPENEYE Name: 1-(3-chloro-2-methyl-phenyl)-3-phenyl-thiourea
IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-phenylthiourea
SYSTEMATIC NAME: 1-(3-chloranyl-2-methyl-phenyl)-3-phenyl-thiourea
MOLECULAR FORMULA: C14H13ClN2S
MOLECULAR WEIGHT: 276.78442
SMILES: CC1=C(C=CC=C1Cl)NC(=S)NC2=CC=CC=C2
Structure:
CAS RN: 350990-04-4
CAS Name: 2-amino-5-methyl-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylic acid methyl ester
OPENEYE Name: methyl 2-amino-4-(4-isopropylphenyl)-5-methyl-thiophene-3-carboxylate
IUPAC Name: methyl 2-amino-5-methyl-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 2-azanyl-5-methyl-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate
MOLECULAR FORMULA: C16H19NO2S
MOLECULAR WEIGHT: 289.39256
SMILES: CC1=C(C(=C(S1)N)C(=O)OC)C2=CC=C(C=C2)C(C)C
Structure:
CAS RN: 350989-54-7
CAS Name: 2-amino-4-(3-chlorophenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-amino-4-(3-chlorophenyl)-5-methyl-thiophene-3-carboxylate
IUPAC Name: ethyl 2-amino-4-(3-chlorophenyl)-5-methylthiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-4-(3-chlorophenyl)-5-methyl-thiophene-3-carboxylate
MOLECULAR FORMULA: C14H14ClNO2S
MOLECULAR WEIGHT: 295.78446
SMILES: CCOC(=O)C1=C(SC(=C1C2=CC(=CC=C2)Cl)C)N
Structure:
CAS RN: 6378-87-6
CAS Name: 3,4,5-triethoxy-N-phenylbenzamide
OPENEYE Name: 3,4,5-triethoxy-N-phenyl-benzamide
IUPAC Name: 3,4,5-triethoxy-N-phenylbenzamide
SYSTEMATIC NAME: 3,4,5-triethoxy-N-phenyl-benzamide
MOLECULAR FORMULA: C19H23NO4
MOLECULAR WEIGHT: 329.39022
SMILES: CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC=CC=C2
Structure:
CAS RN: 52158-14-2
CAS Name: 4-(3,4-dichloroanilino)-3-pyridinesulfonamide
OPENEYE Name: 4-(3,4-dichloroanilino)pyridine-3-sulfonamide
IUPAC Name: 4-(3,4-dichloroanilino)pyridine-3-sulfonamide
SYSTEMATIC NAME: 4-[(3,4-dichlorophenyl)amino]pyridine-3-sulfonamide
MOLECULAR FORMULA: C11H9Cl2N3O2S
MOLECULAR WEIGHT: 318.17906
SMILES: C1=CC(=C(C=C1NC2=C(C=NC=C2)S(=O)(=O)N)Cl)Cl
Structure:
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