1-(4-butylphenyl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-butylphenyl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(4-butylbenzoyl)piperidine-4-carboxylic acid CAS Name: 1-[(4-butylphenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4-butylbenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-(4-butylbenzoyl)isonipecotic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C17H23NO3/c1-2-3-4-13-5-7-14(8-6-13)16(19)18-11-9-15(10-12-18)17(20)21/h5-8,15H,2-4,9-12H2,1H3,(H,20,21)