[3-(4-nitrophenoxy)-2-oxidanyl-propyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [3-(4-nitrophenoxy)-2-oxidanyl-propyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: [2-hydroxy-3-(4-nitrophenoxy)propyl] 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid [2-hydroxy-3-(4-nitrophenoxy)propyl] ester IUPAC Name: [2-hydroxy-3-(4-nitrophenoxy)propyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid [2-hydroxy-3-(4-nitrophenoxy)propyl] ester Formula: C26H26N2O8 MolecularWeight: 494.49324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(COC2=CC=C(C=C2)[N+](=O)[O-])O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(COC2=CC=C(C=C2)[N+](=O)[O-])O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H26N2O8/c29-22(17-34-23-13-11-21(12-14-23)28(32)33)18-35-25(30)24(15-19-7-3-1-4-8-19)27-26(31)36-16-20-9-5-2-6-10-20/h1-14,22,24,29H,15-18H2,(H,27,31)