1-(phenylmethyl)-3-(propylamino)piperidine-3-carboxylic acid

Systemtic Name: 1-(phenylmethyl)-3-(propylamino)piperidine-3-carboxylic acid Openeye Name: 1-benzyl-3-(propylamino)piperidine-3-carboxylic acid CAS Name: 1-(phenylmethyl)-3-(propylamino)-3-piperidinecarboxylic acid IUPAC Name: 1-benzyl-3-(propylamino)piperidine-3-carboxylic acid Traditional Name: 1-benzyl-3-(propylamino)nipecotic acid Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1(CCCN(C1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCNC1(CCCN(C1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H24N2O2/c1-2-10-17-16(15(19)20)9-6-11-18(13-16)12-14-7-4-3-5-8-14/h3-5,7-8,17H,2,6,9-13H2,1H3,(H,19,20)