4-[2-[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[2-[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridyl]acetyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-1-oxoethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[2-[3-chloro-2-keto-5-(trifluoromethyl)-1-pyridyl]acetyl]amino]-3-methyl-benzoic acid Formula: C16H12ClF3N2O4 MolecularWeight: 388.72569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CN2C=C(C=C(C2=O)Cl)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CN2C=C(C=C(C2=O)Cl)C(F)(F)F

InChI

InChI=1S/C16H12ClF3N2O4/c1-8-4-9(15(25)26)2-3-12(8)21-13(23)7-22-6-10(16(18,19)20)5-11(17)14(22)24/h2-6H,7H2,1H3,(H,21,23)(H,25,26)