[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 4-(methylsulfonylmethyl)benzoate Openeye Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C22H20ClNO6S2 MolecularWeight: 493.9803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClNO6S2/c1-24(32(28,29)21-13-7-18(23)8-14-21)19-9-11-20(12-10-19)30-22(25)17-5-3-16(4-6-17)15-31(2,26)27/h3-14H,15H2,1-2H3