3-[4-[(Z)-N-methylsulfonyloxy-C-(trifluoromethyl)carbonimidoyl]phenoxy]propyl sulfate

Systemtic Name: 3-[4-[(Z)-N-methylsulfonyloxy-C-(trifluoromethyl)carbonimidoyl]phenoxy]propyl sulfate Openeye Name: 3-[4-[(Z)-N-methylsulfonyloxy-C-(trifluoromethyl)carbonimidoyl]phenoxy]propyl sulfate CAS Name: 3-[4-[(1Z)-2,2,2-trifluoro-1-methylsulfonyloxyiminoethyl]phenoxy]propyl sulfate IUPAC Name: 3-[4-[(Z)-N-methylsulfonyloxy-C-(trifluoromethyl)carbonimidoyl]phenoxy]propyl sulfate Traditional Name: 3-[4-[(Z)-N-methylsulfonyloxy-C-(trifluoromethyl)carbonimidoyl]phenoxy]propyl sulfate Formula: C12H13F3NO8S2- MolecularWeight: 420.35873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)ON=C(C1=CC=C(C=C1)OCCCOS(=O)(=O)[O-])C(F)(F)F

Isomeric SMILES

CS(=O)(=O)O/N=C(/C1=CC=C(C=C1)OCCCOS(=O)(=O)[O-])\C(F)(F)F

InChI

InChI=1S/C12H14F3NO8S2/c1-25(17,18)24-16-11(12(13,14)15)9-3-5-10(6-4-9)22-7-2-8-23-26(19,20)21/h3-6H,2,7-8H2,1H3,(H,19,20,21)/p-1/b16-11-