methyl (1E)-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-dimethoxyphosphoryl-2-nitro-benzenecarboximidate

Systemtic Name: methyl (1E)-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-dimethoxyphosphoryl-2-nitro-benzenecarboximidate Openeye Name: methyl (1E)-5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-dimethoxyphosphoryl-2-nitro-benzenecarboximidate CAS Name: (1E)-5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-dimethoxyphosphoryl-2-nitrobenzenecarboximidic acid methyl ester IUPAC Name: methyl (1E)-5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-dimethoxyphosphoryl-2-nitrobenzenecarboximidate Traditional Name: (1E)-5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-dimethoxyphosphoryl-2-nitro-benzenecarboximidic acid methyl ester Formula: C17H15ClF3N2O7P MolecularWeight: 482.732171

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NP(=O)(OC)OC)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CO/C(=N/P(=O)(OC)OC)/C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClF3N2O7P/c1-27-16(22-31(26,28-2)29-3)12-9-11(5-6-14(12)23(24)25)30-15-7-4-10(8-13(15)18)17(19,20)21/h4-9H,1-3H3/b22-16+