1-[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(3-ethylanilino)-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(3-ethylanilino)-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-ethylanilino)-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(3-ethylanilino)-2-keto-ethyl]isonipecotic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C16H22N2O3/c1-2-12-4-3-5-14(10-12)17-15(19)11-18-8-6-13(7-9-18)16(20)21/h3-5,10,13H,2,6-9,11H2,1H3,(H,17,19)(H,20,21)