[4-[[[(E)-2-phenylethenyl]sulfonyl-propan-2-yl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-[[[(E)-2-phenylethenyl]sulfonyl-propan-2-yl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-[[isopropyl-[(E)-styryl]sulfonyl-amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-[[[(E)-2-phenylethenyl]sulfonyl-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [4-[[[(E)-2-phenylethenyl]sulfonyl-propan-2-ylamino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-[[isopropyl-[(E)-styryl]sulfonyl-amino]methyl]phenyl] ester Formula: C24H24FNO5S2 MolecularWeight: 489.579463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C24H24FNO5S2/c1-19(2)26(32(27,28)17-16-20-6-4-3-5-7-20)18-21-8-12-23(13-9-21)31-33(29,30)24-14-10-22(25)11-15-24/h3-17,19H,18H2,1-2H3/b17-16+