3-[[1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-2-(phenylmethyl)propanoic acid

Systemtic Name: 3-[[1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-2-(phenylmethyl)propanoic acid Openeye Name: 3-[[2-[(2-amino-2-oxo-ethyl)amino]-1-methyl-2-oxo-ethyl]amino]-2-benzyl-3-oxo-propanoic acid CAS Name: 3-[[1-[(2-amino-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-3-oxo-2-(phenylmethyl)propanoic acid IUPAC Name: 3-[[1-[(2-amino-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-2-benzyl-3-oxopropanoic acid Traditional Name: 3-[[2-[(2-amino-2-keto-ethyl)amino]-2-keto-1-methyl-ethyl]amino]-2-benzyl-3-keto-propionic acid Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)N)NC(=O)C(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C(=O)NCC(=O)N)NC(=O)C(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C15H19N3O5/c1-9(13(20)17-8-12(16)19)18-14(21)11(15(22)23)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,16,19)(H,17,20)(H,18,21)(H,22,23)