[4-[3-(2-methylpropoxy)propylsulfamoyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[3-(2-methylpropoxy)propylsulfamoyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-(3-isobutoxypropylsulfamoyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[3-(2-methylpropoxy)propylsulfamoyl]phenyl] ester IUPAC Name: [4-[3-(2-methylpropoxy)propylsulfamoyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-(3-isobutoxypropylsulfamoyl)phenyl] ester Formula: C20H27NO6S2 MolecularWeight: 441.56148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)S(=O)(=O)NCCCOCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)S(=O)(=O)NCCCOCC(C)C

InChI

InChI=1S/C20H27NO6S2/c1-16(2)15-26-14-4-13-21-28(22,23)19-11-7-18(8-12-19)27-29(24,25)20-9-5-17(3)6-10-20/h5-12,16,21H,4,13-15H2,1-3H3