CAS RN: 197507-59-8
CAS Name: 1,6-naphthyridine-2-carboxylic acid
OPENEYE Name: 1,6-naphthyridine-2-carboxylic acid
IUPAC Name: 1,6-naphthyridine-2-carboxylic acid
SYSTEMATIC NAME: 1,6-naphthyridine-2-carboxylic acid
MOLECULAR FORMULA: C9H6N2O2
MOLECULAR WEIGHT: 174.15614
SMILES: C1=CC(=NC2=C1C=NC=C2)C(=O)O
Structure:
CAS RN: 51859-12-2
CAS Name: 3,5-bis(methylsulfonyl)aniline
OPENEYE Name: 3,5-bis(methylsulfonyl)aniline
IUPAC Name: 3,5-bis(methylsulfonyl)aniline
SYSTEMATIC NAME: 3,5-bis(methylsulfonyl)aniline
MOLECULAR FORMULA: C8H11NO4S2
MOLECULAR WEIGHT: 249.30724
SMILES: CS(=O)(=O)C1=CC(=CC(=C1)N)S(=O)(=O)C
Structure:
CAS RN: 32710-65-9
CAS Name: 2,6-dichloro-4-pyridinecarbonitrile
OPENEYE Name: 2,6-dichloropyridine-4-carbonitrile
IUPAC Name: 2,6-dichloropyridine-4-carbonitrile
SYSTEMATIC NAME: 2,6-bis(chloranyl)pyridine-4-carbonitrile
MOLECULAR FORMULA: C6H2Cl2N2
MOLECULAR WEIGHT: 172.99948
SMILES: C1=C(C=C(N=C1Cl)Cl)C#N
Structure:
CAS RN: 55745-70-5
CAS Name: 2,3-dihydrobenzofuran-5-carboxaldehyde
OPENEYE Name: 2,3-dihydrobenzofuran-5-carbaldehyde
IUPAC Name: 2,3-dihydro-1-benzofuran-5-carbaldehyde
SYSTEMATIC NAME: 2,3-dihydro-1-benzofuran-5-carbaldehyde
MOLECULAR FORMULA: C9H8O2
MOLECULAR WEIGHT: 148.15862
SMILES: C1COC2=C1C=C(C=C2)C=O
Structure:
CAS RN: 79099-07-3
CAS Name: 4-oxo-1-piperidinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 4-oxopiperidine-1-carboxylate
IUPAC Name: tert-butyl 4-oxopiperidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 4-oxidanylidenepiperidine-1-carboxylate
MOLECULAR FORMULA: C10H17NO3
MOLECULAR WEIGHT: 199.24688
SMILES: CC(C)(C)OC(=O)N1CCC(=O)CC1
Structure:
CAS RN: 386715-42-0
CAS Name: (2-propan-2-yloxyphenyl)methanamine
OPENEYE Name: (2-isopropoxyphenyl)methanamine
IUPAC Name: (2-propan-2-yloxyphenyl)methanamine
SYSTEMATIC NAME: (2-propan-2-yloxyphenyl)methanamine
MOLECULAR FORMULA: C10H15NO
MOLECULAR WEIGHT: 165.2322
SMILES: CC(C)OC1=CC=CC=C1CN
Structure:
CAS RN: 205985-98-4
CAS Name: 3-(2-chlorophenyl)-3-oxopropanoic acid methyl ester
OPENEYE Name: methyl 3-(2-chlorophenyl)-3-oxo-propanoate
IUPAC Name: methyl 3-(2-chlorophenyl)-3-oxopropanoate
SYSTEMATIC NAME: methyl 3-(2-chlorophenyl)-3-oxidanylidene-propanoate
MOLECULAR FORMULA: C10H9ClO3
MOLECULAR WEIGHT: 212.62966
SMILES: COC(=O)CC(=O)C1=CC=CC=C1Cl
Structure:
CAS RN: 212755-76-5
CAS Name: 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoic acid methyl ester
OPENEYE Name: methyl 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoate
IUPAC Name: methyl 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoate
SYSTEMATIC NAME: methyl 3-oxidanylidene-3-[4-(trifluoromethyl)phenyl]propanoate
MOLECULAR FORMULA: C11H9F3O3
MOLECULAR WEIGHT: 246.18257
SMILES: COC(=O)CC(=O)C1=CC=C(C=C1)C(F)(F)F
Structure:
CAS RN: 212755-77-6
CAS Name: 3-oxo-3-[2-(trifluoromethyl)phenyl]propanoic acid methyl ester
OPENEYE Name: methyl 3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate
IUPAC Name: methyl 3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate
SYSTEMATIC NAME: methyl 3-oxidanylidene-3-[2-(trifluoromethyl)phenyl]propanoate
MOLECULAR FORMULA: C11H9F3O3
MOLECULAR WEIGHT: 246.18257
SMILES: COC(=O)CC(=O)C1=CC=CC=C1C(F)(F)F
Structure:
CAS RN: 205873-28-5
CAS Name: 5-methylsulfonyl-1H-indole-2-carboxylic acid methyl ester
OPENEYE Name: methyl 5-methylsulfonyl-1H-indole-2-carboxylate
IUPAC Name: methyl 5-methylsulfonyl-1H-indole-2-carboxylate
SYSTEMATIC NAME: methyl 5-methylsulfonyl-1H-indole-2-carboxylate
MOLECULAR FORMULA: C11H11NO4S
MOLECULAR WEIGHT: 253.27434
SMILES: COC(=O)C1=CC2=C(N1)C=CC(=C2)S(=O)(=O)C
Structure:
CAS RN: 133831-28-4
CAS Name: 3-formyl-1H-indole-6-carboxylic acid methyl ester
OPENEYE Name: methyl 3-formyl-1H-indole-6-carboxylate
IUPAC Name: methyl 3-formyl-1H-indole-6-carboxylate
SYSTEMATIC NAME: methyl 3-methanoyl-1H-indole-6-carboxylate
MOLECULAR FORMULA: C11H9NO3
MOLECULAR WEIGHT: 203.19406
SMILES: COC(=O)C1=CC2=C(C=C1)C(=CN2)C=O
Structure:
CAS RN: 387350-58-5
CAS Name: 3-formyl-1H-indole-6-carboxylic acid methyl ester
OPENEYE Name: methyl 3-formyl-1H-indole-6-carboxylate
IUPAC Name: methyl 3-formyl-1H-indole-6-carboxylate
SYSTEMATIC NAME: methyl 3-methanoyl-1H-indole-6-carboxylate
MOLECULAR FORMULA: C11H9NO3
MOLECULAR WEIGHT: 203.19406
SMILES: COC(=O)C1=CC2=C(C=C1)C(=CN2)C=O
Structure:
CAS RN: 20951-05-7
CAS Name: 2,6-dichloro-4-methylsulfonylphenol
OPENEYE Name: 2,6-dichloro-4-methylsulfonyl-phenol
IUPAC Name: 2,6-dichloro-4-methylsulfonylphenol
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-methylsulfonyl-phenol
MOLECULAR FORMULA: C7H6Cl2O3S
MOLECULAR WEIGHT: 241.09174
SMILES: CS(=O)(=O)C1=CC(=C(C(=C1)Cl)O)Cl
Structure:
CAS RN: 53250-83-2
CAS Name: 2-chloro-4-methylsulfonylbenzoic acid
OPENEYE Name: 2-chloro-4-methylsulfonyl-benzoic acid
IUPAC Name: 2-chloro-4-methylsulfonylbenzoic acid
SYSTEMATIC NAME: 2-chloranyl-4-methylsulfonyl-benzoic acid
MOLECULAR FORMULA: C8H7ClO4S
MOLECULAR WEIGHT: 234.65678
SMILES: CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl
Structure:
CAS RN: 74784-70-6
CAS Name: 5-(trifluoromethyl)-2-pyridinamine
OPENEYE Name: 5-(trifluoromethyl)pyridin-2-amine
IUPAC Name: 5-(trifluoromethyl)pyridin-2-amine
SYSTEMATIC NAME: 5-(trifluoromethyl)pyridin-2-amine
MOLECULAR FORMULA: C6H5F3N2
MOLECULAR WEIGHT: 162.11251
SMILES: C1=CC(=NC=C1C(F)(F)F)N
Structure:
CAS RN: 56442-17-2
CAS Name: 4-[(4-fluorophenyl)methoxy]benzaldehyde
OPENEYE Name: 4-[(4-fluorophenyl)methoxy]benzaldehyde
IUPAC Name: 4-[(4-fluorophenyl)methoxy]benzaldehyde
SYSTEMATIC NAME: 4-[(4-fluorophenyl)methoxy]benzaldehyde
MOLECULAR FORMULA: C14H11FO2
MOLECULAR WEIGHT: 230.234343
SMILES: C1=CC(=CC=C1COC2=CC=C(C=C2)C=O)F
Structure:
CAS RN: 783-13-1
CAS Name: (E)-3-[4-(trifluoromethoxy)phenyl]-2-propenoic acid
OPENEYE Name: (E)-3-[4-(trifluoromethoxy)phenyl]prop-2-enoic acid
IUPAC Name: (E)-3-[4-(trifluoromethoxy)phenyl]prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-[4-(trifluoromethyloxy)phenyl]prop-2-enoic acid
MOLECULAR FORMULA: C10H7F3O3
MOLECULAR WEIGHT: 232.15599
SMILES: C1=CC(=CC=C1/C=C/C(=O)O)OC(F)(F)F
Structure:
CAS RN: 96980-65-3
CAS Name: 2-chloro-N-(2,4-difluorophenyl)acetamide
OPENEYE Name: 2-chloro-N-(2,4-difluorophenyl)acetamide
IUPAC Name: 2-chloro-N-(2,4-difluorophenyl)acetamide
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]-2-chloranyl-ethanamide
MOLECULAR FORMULA: C8H6ClF2NO
MOLECULAR WEIGHT: 205.589146
SMILES: C1=CC(=C(C=C1F)F)NC(=O)CCl
Structure:
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