(phenylmethyl) 2-[2,3-bis(azanyl)-4-oxidanylidene-4-(1-phenylmethoxycarbonylpyrrolidin-2-yl)butanoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2,3-bis(azanyl)-4-oxidanylidene-4-(1-phenylmethoxycarbonylpyrrolidin-2-yl)butanoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[2,3-diamino-4-(1-benzyloxycarbonylpyrrolidin-2-yl)-4-oxo-butanoyl]pyrrolidine-1-carboxylate CAS Name: 2-[2,3-diamino-1,4-dioxo-4-(1-phenylmethoxycarbonyl-2-pyrrolidinyl)butyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2,3-diamino-4-oxo-4-(1-phenylmethoxycarbonylpyrrolidin-2-yl)butanoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2,3-diamino-4-(1-carbobenzoxypyrrolidin-2-yl)-4-keto-butanoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C28H34N4O6 MolecularWeight: 522.59276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C(C(C(=O)C3CCCN3C(=O)OCC4=CC=CC=C4)N)N

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C(C(C(=O)C3CCCN3C(=O)OCC4=CC=CC=C4)N)N

InChI

InChI=1S/C28H34N4O6/c29-23(25(33)21-13-7-15-31(21)27(35)37-17-19-9-3-1-4-10-19)24(30)26(34)22-14-8-16-32(22)28(36)38-18-20-11-5-2-6-12-20/h1-6,9-12,21-24H,7-8,13-18,29-30H2