1-[1-[[4-azanyl-4-oxidanylidene-2-(2-phenylethanoylamino)butanoyl]amino]-2-oxidanyl-4-phenyl-butyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-[[4-azanyl-4-oxidanylidene-2-(2-phenylethanoylamino)butanoyl]amino]-2-oxidanyl-4-phenyl-butyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[1-[[4-amino-4-oxo-2-[(2-phenylacetyl)amino]butanoyl]amino]-2-hydroxy-4-phenyl-butyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-[[4-amino-1,4-dioxo-2-[(1-oxo-2-phenylethyl)amino]butyl]amino]-2-hydroxy-4-phenylbutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-[[4-amino-4-oxo-2-[(2-phenylacetyl)amino]butanoyl]amino]-2-hydroxy-4-phenylbutyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-[[4-amino-4-keto-2-[(2-phenylacetyl)amino]butanoyl]amino]-2-hydroxy-4-phenyl-butyl]proline Formula: C27H34N4O6 MolecularWeight: 510.58206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C(CCC2=CC=CC=C2)O)NC(=O)C(CC(=O)N)NC(=O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C(CCC2=CC=CC=C2)O)NC(=O)C(CC(=O)N)NC(=O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H34N4O6/c28-23(33)17-20(29-24(34)16-19-10-5-2-6-11-19)26(35)30-25(31-15-7-12-21(31)27(36)37)22(32)14-13-18-8-3-1-4-9-18/h1-6,8-11,20-22,25,32H,7,12-17H2,(H2,28,33)(H,29,34)(H,30,35)(H,36,37)