(4-nitrophenyl)methyl N-[4-oxidanyl-1-(5-phenylpentanoylamino)pyrrolidin-3-yl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[4-oxidanyl-1-(5-phenylpentanoylamino)pyrrolidin-3-yl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[4-hydroxy-1-(5-phenylpentanoylamino)pyrrolidin-3-yl]carbamate CAS Name: N-[4-hydroxy-1-[(1-oxo-5-phenylpentyl)amino]-3-pyrrolidinyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[4-hydroxy-1-(5-phenylpentanoylamino)pyrrolidin-3-yl]carbamate Traditional Name: N-[4-hydroxy-1-(5-phenylpentanoylamino)pyrrolidin-3-yl]carbamic acid (4-nitrobenzyl) ester Formula: C23H28N4O6 MolecularWeight: 456.49162

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1NC(=O)CCCCC2=CC=CC=C2)O)NC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(C(CN1NC(=O)CCCCC2=CC=CC=C2)O)NC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O6/c28-21-15-26(25-22(29)9-5-4-8-17-6-2-1-3-7-17)14-20(21)24-23(30)33-16-18-10-12-19(13-11-18)27(31)32/h1-3,6-7,10-13,20-21,28H,4-5,8-9,14-16H2,(H,24,30)(H,25,29)