3-methyl-4-[[1-(2-methylphenyl)carbonylpiperidin-4-yl]carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[[1-(2-methylphenyl)carbonylpiperidin-4-yl]carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[[1-(2-methylbenzoyl)piperidine-4-carbonyl]amino]benzoic acid CAS Name: 3-methyl-4-[[[1-[(2-methylphenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[[1-(2-methylbenzoyl)piperidine-4-carbonyl]amino]benzoic acid Traditional Name: 3-methyl-4-[(1-o-toluoylisonipecotoyl)amino]benzoic acid Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)C(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3)C(=O)O)C

InChI

InChI=1S/C22H24N2O4/c1-14-5-3-4-6-18(14)21(26)24-11-9-16(10-12-24)20(25)23-19-8-7-17(22(27)28)13-15(19)2/h3-8,13,16H,9-12H2,1-2H3,(H,23,25)(H,27,28)