[(3-nitrophenyl)-(phenylmethoxycarbonylamino)methyl] ethanoate

Systemtic Name: [(3-nitrophenyl)-(phenylmethoxycarbonylamino)methyl] ethanoate Openeye Name: [benzyloxycarbonylamino-(3-nitrophenyl)methyl] acetate CAS Name: acetic acid [(3-nitrophenyl)-(phenylmethoxycarbonylamino)methyl] ester IUPAC Name: [(3-nitrophenyl)-(phenylmethoxycarbonylamino)methyl] acetate Traditional Name: acetic acid [benzyloxycarbonylamino-(3-nitrophenyl)methyl] ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC(C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H16N2O6/c1-12(20)25-16(14-8-5-9-15(10-14)19(22)23)18-17(21)24-11-13-6-3-2-4-7-13/h2-10,16H,11H2,1H3,(H,18,21)