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

Systemtic Name: (phenylmethyl) 2-[[2,4-bis(azanyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoate Openeye Name: benzyl 2-[(2,4-diamino-4-oxo-butanoyl)amino]-3-phenyl-propanoate CAS Name: 2-[(2,4-diamino-1,4-dioxobutyl)amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2,4-diamino-4-oxobutanoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(2,4-diamino-4-keto-butanoyl)amino]-3-phenyl-propionic acid benzyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)NC(=O)C(CC(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)NC(=O)C(CC(=O)N)N

InChI

InChI=1S/C20H23N3O4/c21-16(12-18(22)24)19(25)23-17(11-14-7-3-1-4-8-14)20(26)27-13-15-9-5-2-6-10-15/h1-10,16-17H,11-13,21H2,(H2,22,24)(H,23,25)