1-[3-(4-methylphenyl)propanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(4-methylphenyl)propanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(p-tolyl)propanoyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(4-methylphenyl)-1-oxopropyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(4-methylphenyl)propanoyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(p-tolyl)propanoyl]nipecotic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C16H21NO3/c1-12-4-6-13(7-5-12)8-9-15(18)17-10-2-3-14(11-17)16(19)20/h4-7,14H,2-3,8-11H2,1H3,(H,19,20)