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

Systemtic Name: 1-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(3-methylanilino)-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(3-methylanilino)-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-methylanilino)-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-keto-2-(m-toluidino)ethyl]isonipecotic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C15H20N2O3/c1-11-3-2-4-13(9-11)16-14(18)10-17-7-5-12(6-8-17)15(19)20/h2-4,9,12H,5-8,10H2,1H3,(H,16,18)(H,19,20)