2-[[2-azanyl-4-oxidanylidene-4-[(phenylmethyl)amino]butanoyl]amino]propanoic acid

Systemtic Name: 2-[[2-azanyl-4-oxidanylidene-4-[(phenylmethyl)amino]butanoyl]amino]propanoic acid Openeye Name: 2-[[2-amino-4-(benzylamino)-4-oxo-butanoyl]amino]propanoic acid CAS Name: 2-[[2-amino-1,4-dioxo-4-[(phenylmethyl)amino]butyl]amino]propanoic acid IUPAC Name: 2-[[2-amino-4-(benzylamino)-4-oxobutanoyl]amino]propanoic acid Traditional Name: 2-[[2-amino-4-(benzylamino)-4-keto-butanoyl]amino]propionic acid Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O4/c1-9(14(20)21)17-13(19)11(15)7-12(18)16-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8,15H2,1H3,(H,16,18)(H,17,19)(H,20,21)