[2-(trifluoromethyl)phenyl]methyl 4-methoxy-2-nitro-benzenesulfonate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 4-methoxy-2-nitro-benzenesulfonate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 4-methoxy-2-nitro-benzenesulfonate CAS Name: 4-methoxy-2-nitrobenzenesulfonic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 4-methoxy-2-nitrobenzenesulfonate Traditional Name: 4-methoxy-2-nitro-benzenesulfonic acid [2-(trifluoromethyl)benzyl] ester Formula: C15H12F3NO6S MolecularWeight: 391.31909

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)OCC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)OCC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12F3NO6S/c1-24-11-6-7-14(13(8-11)19(20)21)26(22,23)25-9-10-4-2-3-5-12(10)15(16,17)18/h2-8H,9H2,1H3