[3-(trifluoromethyl)phenyl] 4-(acetamidomethyl)benzenesulfonate

Systemtic Name: [3-(trifluoromethyl)phenyl] 4-(acetamidomethyl)benzenesulfonate Openeye Name: [3-(trifluoromethyl)phenyl] 4-(acetamidomethyl)benzenesulfonate CAS Name: 4-(acetamidomethyl)benzenesulfonic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: [3-(trifluoromethyl)phenyl] 4-(acetamidomethyl)benzenesulfonate Traditional Name: 4-(acetamidomethyl)benzenesulfonic acid [3-(trifluoromethyl)phenyl] ester Formula: C16H14F3NO4S MolecularWeight: 373.34687

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H14F3NO4S/c1-11(21)20-10-12-5-7-15(8-6-12)25(22,23)24-14-4-2-3-13(9-14)16(17,18)19/h2-9H,10H2,1H3,(H,20,21)