4-(butylamino)-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 4-(butylamino)-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid Openeye Name: 2-(benzylamino)-4-(butylamino)-4-oxo-butanoic acid CAS Name: 4-(butylamino)-4-oxo-2-[(phenylmethyl)amino]butanoic acid IUPAC Name: 2-(benzylamino)-4-(butylamino)-4-oxobutanoic acid Traditional Name: 2-(benzylamino)-4-(butylamino)-4-keto-butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-2-3-9-16-14(18)10-13(15(19)20)17-11-12-7-5-4-6-8-12/h4-8,13,17H,2-3,9-11H2,1H3,(H,16,18)(H,19,20)