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

Systemtic Name: [3-(trifluoromethyl)phenyl] 2-methoxy-4-nitro-benzenesulfonate Openeye Name: [3-(trifluoromethyl)phenyl] 2-methoxy-4-nitro-benzenesulfonate CAS Name: 2-methoxy-4-nitrobenzenesulfonic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: [3-(trifluoromethyl)phenyl] 2-methoxy-4-nitrobenzenesulfonate Traditional Name: 2-methoxy-4-nitro-benzenesulfonic acid [3-(trifluoromethyl)phenyl] ester Formula: C14H10F3NO6S MolecularWeight: 377.29251

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H10F3NO6S/c1-23-12-8-10(18(19)20)5-6-13(12)25(21,22)24-11-4-2-3-9(7-11)14(15,16)17/h2-8H,1H3