4-[[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[[6-(3-bromophenyl)-2-methyl-pyridine-3-carbonyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[[6-(3-bromophenyl)-2-methyl-3-pyridinyl]-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[6-(3-bromophenyl)-2-methylpyridine-3-carbonyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[6-(3-bromophenyl)-2-methyl-nicotinoyl]amino]-3-methyl-benzoic acid Formula: C21H17BrN2O3 MolecularWeight: 425.27528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=C(N=C(C=C2)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=C(N=C(C=C2)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C21H17BrN2O3/c1-12-10-15(21(26)27)6-8-18(12)24-20(25)17-7-9-19(23-13(17)2)14-4-3-5-16(22)11-14/h3-11H,1-2H3,(H,24,25)(H,26,27)