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

Systemtic Name: 1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(benzylamino)-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-oxo-2-[(phenylmethyl)amino]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(benzylamino)-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(benzylamino)-2-keto-ethyl]nipecotic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC(=O)NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H20N2O3/c18-14(16-9-12-5-2-1-3-6-12)11-17-8-4-7-13(10-17)15(19)20/h1-3,5-6,13H,4,7-11H2,(H,16,18)(H,19,20)