[diethoxyphosphoryl-[3-(pyridin-2-ylmethoxy)phenyl]methyl] diethyl phosphate

Systemtic Name: [diethoxyphosphoryl-[3-(pyridin-2-ylmethoxy)phenyl]methyl] diethyl phosphate Openeye Name: [diethoxyphosphoryl-[3-(2-pyridylmethoxy)phenyl]methyl] diethyl phosphate CAS Name: phosphoric acid [diethoxyphosphoryl-[3-(2-pyridinylmethoxy)phenyl]methyl] diethyl ester IUPAC Name: [diethoxyphosphoryl-[3-(pyridin-2-ylmethoxy)phenyl]methyl] diethyl phosphate Traditional Name: phosphoric acid [diethoxyphosphoryl-[3-(2-pyridylmethoxy)phenyl]methyl] diethyl ester Formula: C21H31NO8P2 MolecularWeight: 487.420262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC(=CC=C1)OCC2=CC=CC=N2)OP(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC(=CC=C1)OCC2=CC=CC=N2)OP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C21H31NO8P2/c1-5-26-31(23,27-6-2)21(30-32(24,28-7-3)29-8-4)18-12-11-14-20(16-18)25-17-19-13-9-10-15-22-19/h9-16,21H,5-8,17H2,1-4H3