[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 3-fluoranyl-4-methoxy-benzenesulfonate

Systemtic Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 3-fluoranyl-4-methoxy-benzenesulfonate Openeye Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 3-fluoro-4-methoxy-benzenesulfonate CAS Name: 3-fluoro-4-methoxybenzenesulfonic acid [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] 3-fluoro-4-methoxybenzenesulfonate Traditional Name: 3-fluoro-4-methoxy-benzenesulfonic acid [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C20H17ClFNO6S2 MolecularWeight: 485.933483

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C(C=C2)OC)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C(C=C2)OC)F)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H17ClFNO6S2/c1-23(30(24,25)17-9-3-14(21)4-10-17)15-5-7-16(8-6-15)29-31(26,27)18-11-12-20(28-2)19(22)13-18/h3-13H,1-2H3