4-oxidanylidene-2-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: 4-oxidanylidene-2-[(phenylmethyl)amino]pentanoic acid Openeye Name: 2-(benzylamino)-4-oxo-pentanoic acid CAS Name: 4-oxo-2-[(phenylmethyl)amino]pentanoic acid IUPAC Name: 2-(benzylamino)-4-oxopentanoic acid Traditional Name: 2-(benzylamino)-4-keto-valeric acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C(=O)O)NCC1=CC=CC=C1

Isomeric SMILES

CC(=O)CC(C(=O)O)NCC1=CC=CC=C1

InChI

InChI=1S/C12H15NO3/c1-9(14)7-11(12(15)16)13-8-10-5-3-2-4-6-10/h2-6,11,13H,7-8H2,1H3,(H,15,16)