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

Systemtic Name: tert-butyl 3-[(4-azanyl-2-benzamido-4-oxidanylidene-butanoyl)amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl 3-[(4-amino-2-benzamido-4-oxo-butanoyl)amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate CAS Name: 3-[(4-amino-2-benzamido-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-benzamido-4-oxobutanoyl)amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylate Traditional Name: 3-[(4-amino-2-benzamido-4-keto-butanoyl)amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C30H38N4O7 MolecularWeight: 566.64532

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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=CC=CC=C3)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=CC=CC=C3)O

InChI

InChI=1S/C30H38N4O7/c1-29(2,3)41-28(39)30(40)23(17-18-34(30)25(36)16-10-13-20-11-6-4-7-12-20)33-27(38)22(19-24(31)35)32-26(37)21-14-8-5-9-15-21/h4-9,11-12,14-15,22-23,40H,10,13,16-19H2,1-3H3,(H2,31,35)(H,32,37)(H,33,38)