[2-diethoxyphosphoryl-1-(3-nitrophenyl)ethyl] diethyl phosphate

Systemtic Name: [2-diethoxyphosphoryl-1-(3-nitrophenyl)ethyl] diethyl phosphate Openeye Name: [2-diethoxyphosphoryl-1-(3-nitrophenyl)ethyl] diethyl phosphate CAS Name: phosphoric acid [2-diethoxyphosphoryl-1-(3-nitrophenyl)ethyl] diethyl ester IUPAC Name: [2-diethoxyphosphoryl-1-(3-nitrophenyl)ethyl] diethyl phosphate Traditional Name: phosphoric acid [2-diethoxyphosphoryl-1-(3-nitrophenyl)ethyl] diethyl ester Formula: C16H27NO9P2 MolecularWeight: 439.334402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(C1=CC(=CC=C1)[N+](=O)[O-])OP(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(CC(C1=CC(=CC=C1)[N+](=O)[O-])OP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C16H27NO9P2/c1-5-22-27(20,23-6-2)13-16(26-28(21,24-7-3)25-8-4)14-10-9-11-15(12-14)17(18)19/h9-12,16H,5-8,13H2,1-4H3