(2S)-N-tert-butyl-1-[(2S,3S)-3-[2-(2-nitrophenoxy)ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-tert-butyl-1-[(2S,3S)-3-[2-(2-nitrophenoxy)ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-tert-butyl-1-[(2S,3S)-2-hydroxy-3-[[2-(2-nitrophenoxy)acetyl]amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-tert-butyl-1-[(2S,3S)-2-hydroxy-3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]-1-oxo-4-phenylbutyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-tert-butyl-1-[(2S,3S)-2-hydroxy-3-[[2-(2-nitrophenoxy)acetyl]amino]-4-phenylbutanoyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-tert-butyl-1-[(2S,3S)-2-hydroxy-3-[[2-(2-nitrophenoxy)acetyl]amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Formula: C27H34N4O7 MolecularWeight: 526.58146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CCCN1C(=O)C(C(CC2=CC=CC=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC2=CC=CC=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C27H34N4O7/c1-27(2,3)29-25(34)21-13-9-15-30(21)26(35)24(33)19(16-18-10-5-4-6-11-18)28-23(32)17-38-22-14-8-7-12-20(22)31(36)37/h4-8,10-12,14,19,21,24,33H,9,13,15-17H2,1-3H3,(H,28,32)(H,29,34)/t19-,21-,24-/m0/s1