[4-[[(4-methoxyphenyl)sulfonyl-propan-2-yl-amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate

Systemtic Name: [4-[[(4-methoxyphenyl)sulfonyl-propan-2-yl-amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate Openeye Name: [4-[[isopropyl-(4-methoxyphenyl)sulfonyl-amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate CAS Name: 3-(trifluoromethyl)benzenesulfonic acid [4-[[(4-methoxyphenyl)sulfonyl-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [4-[[(4-methoxyphenyl)sulfonyl-propan-2-ylamino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate Traditional Name: 3-(trifluoromethyl)benzenesulfonic acid [4-[[isopropyl-(4-methoxyphenyl)sulfonyl-amino]methyl]phenyl] ester Formula: C24H24F3NO6S2 MolecularWeight: 543.57567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H24F3NO6S2/c1-17(2)28(35(29,30)22-13-11-20(33-3)12-14-22)16-18-7-9-21(10-8-18)34-36(31,32)23-6-4-5-19(15-23)24(25,26)27/h4-15,17H,16H2,1-3H3