2-[4-(4-methylphenyl)carbonylpiperidin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[4-(4-methylphenyl)carbonylpiperidin-1-yl]carbonylbenzoic acid Openeye Name: 2-[4-(4-methylbenzoyl)piperidine-1-carbonyl]benzoic acid CAS Name: 2-[[4-[(4-methylphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[4-(4-methylbenzoyl)piperidine-1-carbonyl]benzoic acid Traditional Name: 2-(4-p-toluoylpiperidine-1-carbonyl)benzoic acid Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H21NO4/c1-14-6-8-15(9-7-14)19(23)16-10-12-22(13-11-16)20(24)17-4-2-3-5-18(17)21(25)26/h2-9,16H,10-13H2,1H3,(H,25,26)