tert-butyl 3-[2-[cyano(phenylmethoxycarbonyl)amino]propanoylamino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 3-[2-[cyano(phenylmethoxycarbonyl)amino]propanoylamino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl 3-[2-[benzyloxycarbonyl(cyano)amino]propanoylamino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate CAS Name: 3-[[2-[cyano(phenylmethoxycarbonyl)amino]-1-oxopropyl]amino]-2-hydroxy-1-(1-oxo-4-phenylbutyl)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[cyano(phenylmethoxycarbonyl)amino]propanoylamino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Traditional Name: 3-[2-[carbobenzoxy(cyano)amino]propanoylamino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C31H38N4O7 MolecularWeight: 578.65602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCN(C1(C(=O)OC(C)(C)C)O)C(=O)CCCC2=CC=CC=C2)N(C#N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1CCN(C1(C(=O)OC(C)(C)C)O)C(=O)CCCC2=CC=CC=C2)N(C#N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C31H38N4O7/c1-22(34(21-32)29(39)41-20-24-14-9-6-10-15-24)27(37)33-25-18-19-35(31(25,40)28(38)42-30(2,3)4)26(36)17-11-16-23-12-7-5-8-13-23/h5-10,12-15,22,25,40H,11,16-20H2,1-4H3,(H,33,37)