2-azanyl-6-oxidanylidene-6-[(phenylmethyl)amino]hexanoic acid

Systemtic Name: 2-azanyl-6-oxidanylidene-6-[(phenylmethyl)amino]hexanoic acid Openeye Name: 2-amino-6-(benzylamino)-6-oxo-hexanoic acid CAS Name: 2-amino-6-oxo-6-[(phenylmethyl)amino]hexanoic acid IUPAC Name: 2-amino-6-(benzylamino)-6-oxohexanoic acid Traditional Name: 2-amino-6-(benzylamino)-6-keto-hexanoic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCC(C(=O)O)N

InChI

InChI=1S/C13H18N2O3/c14-11(13(17)18)7-4-8-12(16)15-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,14H2,(H,15,16)(H,17,18)