2-(dimethoxyphosphorylmethylsulfanyl)-1-nitro-4-[4-(trifluoromethyl)phenoxy]benzene

Systemtic Name: 2-(dimethoxyphosphorylmethylsulfanyl)-1-nitro-4-[4-(trifluoromethyl)phenoxy]benzene Openeye Name: 2-(dimethoxyphosphorylmethylsulfanyl)-1-nitro-4-[4-(trifluoromethyl)phenoxy]benzene CAS Name: 2-(dimethoxyphosphorylmethylthio)-1-nitro-4-[4-(trifluoromethyl)phenoxy]benzene IUPAC Name: 2-(dimethoxyphosphorylmethylsulfanyl)-1-nitro-4-[4-(trifluoromethyl)phenoxy]benzene Traditional Name: 2-(dimethoxyphosphorylmethylthio)-1-nitro-4-[4-(trifluoromethyl)phenoxy]benzene Formula: C16H15F3NO6PS MolecularWeight: 437.327371

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(CSC1=C(C=CC(=C1)OC2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-])OC

Isomeric SMILES

COP(=O)(CSC1=C(C=CC(=C1)OC2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-])OC

InChI

InChI=1S/C16H15F3NO6PS/c1-24-27(23,25-2)10-28-15-9-13(7-8-14(15)20(21)22)26-12-5-3-11(4-6-12)16(17,18)19/h3-9H,10H2,1-2H3