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

Systemtic Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] benzenesulfonate Openeye Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C19H16FNO5S2 MolecularWeight: 421.462443

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H16FNO5S2/c1-21(27(22,23)19-10-6-5-9-18(19)20)15-11-13-16(14-12-15)26-28(24,25)17-7-3-2-4-8-17/h2-14H,1H3