3-methyl-2-[2-[(phenylmethyl)amino]propanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[(phenylmethyl)amino]propanoylamino]butanoic acid Openeye Name: 2-[2-(benzylamino)propanoylamino]-3-methyl-butanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[(phenylmethyl)amino]propyl]amino]butanoic acid IUPAC Name: 2-[2-(benzylamino)propanoylamino]-3-methylbutanoic acid Traditional Name: 2-[2-(benzylamino)propanoylamino]-3-methyl-butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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