(2-diethoxyphosphoryl-4-nitro-phenyl) benzoate

Systemtic Name: (2-diethoxyphosphoryl-4-nitro-phenyl) benzoate Openeye Name: (2-diethoxyphosphoryl-4-nitro-phenyl) benzoate CAS Name: benzoic acid (2-diethoxyphosphoryl-4-nitrophenyl) ester IUPAC Name: (2-diethoxyphosphoryl-4-nitrophenyl) benzoate Traditional Name: benzoic acid (2-diethoxyphosphoryl-4-nitro-phenyl) ester Formula: C17H18NO7P MolecularWeight: 379.301081

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(C=CC(=C1)[N+](=O)[O-])OC(=O)C2=CC=CC=C2)OCC

Isomeric SMILES

CCOP(=O)(C1=C(C=CC(=C1)[N+](=O)[O-])OC(=O)C2=CC=CC=C2)OCC

InChI

InChI=1S/C17H18NO7P/c1-3-23-26(22,24-4-2)16-12-14(18(20)21)10-11-15(16)25-17(19)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3