[4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 5-fluoranyl-2-methyl-benzenesulfonate

Systemtic Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 5-fluoranyl-2-methyl-benzenesulfonate Openeye Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 5-fluoro-2-methyl-benzenesulfonate CAS Name: 5-fluoro-2-methylbenzenesulfonic acid [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] 5-fluoro-2-methylbenzenesulfonate Traditional Name: 5-fluoro-2-methyl-benzenesulfonic acid [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C20H17F2NO5S2 MolecularWeight: 453.479486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H17F2NO5S2/c1-14-7-8-15(21)13-20(14)30(26,27)28-17-11-9-16(10-12-17)23(2)29(24,25)19-6-4-3-5-18(19)22/h3-13H,1-2H3