2-[cyclohexyl-dimethoxyphosphoryl-[4-nitro-3-(trifluoromethyl)phenyl]methoxy]pyridine

Systemtic Name: 2-[cyclohexyl-dimethoxyphosphoryl-[4-nitro-3-(trifluoromethyl)phenyl]methoxy]pyridine Openeye Name: 2-[cyclohexyl-dimethoxyphosphoryl-[4-nitro-3-(trifluoromethyl)phenyl]methoxy]pyridine CAS Name: 2-[cyclohexyl-dimethoxyphosphoryl-[4-nitro-3-(trifluoromethyl)phenyl]methoxy]pyridine IUPAC Name: 2-[cyclohexyl-dimethoxyphosphoryl-[4-nitro-3-(trifluoromethyl)phenyl]methoxy]pyridine Traditional Name: 2-[cyclohexyl-dimethoxyphosphoryl-[4-nitro-3-(trifluoromethyl)phenyl]methoxy]pyridine Formula: C21H24F3N2O6P MolecularWeight: 488.394031

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C(C1CCCCC1)(C2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)OC3=CC=CC=N3)OC

Isomeric SMILES

COP(=O)(C(C1CCCCC1)(C2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)OC3=CC=CC=N3)OC

InChI

InChI=1S/C21H24F3N2O6P/c1-30-33(29,31-2)20(15-8-4-3-5-9-15,32-19-10-6-7-13-25-19)16-11-12-18(26(27)28)17(14-16)21(22,23)24/h6-7,10-15H,3-5,8-9H2,1-2H3