(phenylmethyl) 2-[[2,4-bis(azanyl)-4-oxidanylidene-butanoyl]-propanoyl-amino]-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[[2,4-bis(azanyl)-4-oxidanylidene-butanoyl]-propanoyl-amino]-3-phenyl-propanoate Openeye Name: benzyl 2-[(2,4-diamino-4-oxo-butanoyl)-propanoyl-amino]-3-phenyl-propanoate CAS Name: 2-[(2,4-diamino-1,4-dioxobutyl)-(1-oxopropyl)amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2,4-diamino-4-oxobutanoyl)-propanoylamino]-3-phenylpropanoate Traditional Name: 2-[(2,4-diamino-4-keto-butanoyl)-propionyl-amino]-3-phenyl-propionic acid benzyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)C(=O)C(CC(=O)N)N

Isomeric SMILES

CCC(=O)N(C(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)C(=O)C(CC(=O)N)N

InChI

InChI=1S/C23H27N3O5/c1-2-21(28)26(22(29)18(24)14-20(25)27)19(13-16-9-5-3-6-10-16)23(30)31-15-17-11-7-4-8-12-17/h3-12,18-19H,2,13-15,24H2,1H3,(H2,25,27)