tert-butyl 3-[[4-azanyl-2-[(4-methoxyquinolin-2-yl)carbonylamino]-4-oxidanylidene-butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 3-[[4-azanyl-2-[(4-methoxyquinolin-2-yl)carbonylamino]-4-oxidanylidene-butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl 3-[[4-amino-2-[(4-methoxyquinoline-2-carbonyl)amino]-4-oxo-butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate CAS Name: 3-[[4-amino-2-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-1,4-dioxobutyl]amino]-2-hydroxy-1-(1-oxo-4-phenylbutyl)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[4-amino-2-[(4-methoxyquinoline-2-carbonyl)amino]-4-oxobutanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Traditional Name: 3-[[4-amino-4-keto-2-[(4-methoxyquinoline-2-carbonyl)amino]butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C34H41N5O8 MolecularWeight: 647.71804

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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)N)NC(=O)C3=NC4=CC=CC=C4C(=C3)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)C1(C(CCN1C(=O)CCCC2=CC=CC=C2)NC(=O)C(CC(=O)N)NC(=O)C3=NC4=CC=CC=C4C(=C3)OC)O

InChI

InChI=1S/C34H41N5O8/c1-33(2,3)47-32(44)34(45)27(17-18-39(34)29(41)16-10-13-21-11-6-5-7-12-21)38-31(43)25(20-28(35)40)37-30(42)24-19-26(46-4)22-14-8-9-15-23(22)36-24/h5-9,11-12,14-15,19,25,27,45H,10,13,16-18,20H2,1-4H3,(H2,35,40)(H,37,42)(H,38,43)