ethyl 3-[[4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl 3-[[4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Openeye Name: ethyl 3-[[4-amino-2-(benzyloxycarbonylamino)-4-oxo-butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate CAS Name: 3-[[4-amino-1,4-dioxo-2-(phenylmethoxycarbonylamino)butyl]amino]-2-hydroxy-1-(1-oxo-4-phenylbutyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Traditional Name: 3-[[4-amino-2-(benzyloxycarbonylamino)-4-keto-butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid ethyl ester Formula: C29H36N4O8 MolecularWeight: 568.61814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CCN1C(=O)CCCC2=CC=CC=C2)NC(=O)C(CC(=O)N)NC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1(C(CCN1C(=O)CCCC2=CC=CC=C2)NC(=O)C(CC(=O)N)NC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C29H36N4O8/c1-2-40-27(37)29(39)23(16-17-33(29)25(35)15-9-14-20-10-5-3-6-11-20)32-26(36)22(18-24(30)34)31-28(38)41-19-21-12-7-4-8-13-21/h3-8,10-13,22-23,39H,2,9,14-19H2,1H3,(H2,30,34)(H,31,38)(H,32,36)