3-methyl-4-[(1-naphthalen-1-ylcarbonylpiperidin-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(1-naphthalen-1-ylcarbonylpiperidin-3-yl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[[1-(naphthalene-1-carbonyl)piperidine-3-carbonyl]amino]benzoic acid CAS Name: 3-methyl-4-[[[1-[1-naphthalenyl(oxo)methyl]-3-piperidinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[[1-(naphthalene-1-carbonyl)piperidine-3-carbonyl]amino]benzoic acid Traditional Name: 3-methyl-4-[[1-(1-naphthoyl)nipecotoyl]amino]benzoic acid Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H24N2O4/c1-16-14-18(25(30)31)11-12-22(16)26-23(28)19-8-5-13-27(15-19)24(29)21-10-4-7-17-6-2-3-9-20(17)21/h2-4,6-7,9-12,14,19H,5,8,13,15H2,1H3,(H,26,28)(H,30,31)