tert-butyl 3-[[4-morpholin-4-yl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 3-[[4-morpholin-4-yl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl 3-[[2-(benzyloxycarbonylamino)-4-morpholino-4-oxo-butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate CAS Name: 2-hydroxy-3-[[4-(4-morpholinyl)-1,4-dioxo-2-(phenylmethoxycarbonylamino)butyl]amino]-1-(1-oxo-4-phenylbutyl)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-hydroxy-3-[[4-morpholin-4-yl-4-oxo-2-(phenylmethoxycarbonylamino)butanoyl]amino]-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Traditional Name: 3-[[2-(benzyloxycarbonylamino)-4-keto-4-morpholino-butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C35H46N4O9 MolecularWeight: 666.76114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(C(CCN1C(=O)CCCC2=CC=CC=C2)NC(=O)C(CC(=O)N3CCOCC3)NC(=O)OCC4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)OC(=O)C1(C(CCN1C(=O)CCCC2=CC=CC=C2)NC(=O)C(CC(=O)N3CCOCC3)NC(=O)OCC4=CC=CC=C4)O

InChI

InChI=1S/C35H46N4O9/c1-34(2,3)48-32(43)35(45)28(17-18-39(35)29(40)16-10-15-25-11-6-4-7-12-25)37-31(42)27(23-30(41)38-19-21-46-22-20-38)36-33(44)47-24-26-13-8-5-9-14-26/h4-9,11-14,27-28,45H,10,15-24H2,1-3H3,(H,36,44)(H,37,42)