3-(methylamino)-4-oxidanylidene-5-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: 3-(methylamino)-4-oxidanylidene-5-[(phenylmethyl)amino]pentanoic acid Openeye Name: 5-(benzylamino)-3-(methylamino)-4-oxo-pentanoic acid CAS Name: 3-(methylamino)-4-oxo-5-[(phenylmethyl)amino]pentanoic acid IUPAC Name: 5-(benzylamino)-3-(methylamino)-4-oxopentanoic acid Traditional Name: 5-(benzylamino)-4-keto-3-(methylamino)valeric acid Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC(=O)O)C(=O)CNCC1=CC=CC=C1

Isomeric SMILES

CNC(CC(=O)O)C(=O)CNCC1=CC=CC=C1

InChI

InChI=1S/C13H18N2O3/c1-14-11(7-13(17)18)12(16)9-15-8-10-5-3-2-4-6-10/h2-6,11,14-15H,7-9H2,1H3,(H,17,18)