[2-methoxy-5-[[2-methoxyethyl-(4-methylphenyl)sulfonyl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [2-methoxy-5-[[2-methoxyethyl-(4-methylphenyl)sulfonyl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [2-methoxy-5-[[2-methoxyethyl(p-tolylsulfonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [2-methoxy-5-[[2-methoxyethyl-(4-methylphenyl)sulfonylamino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[2-methoxyethyl-(4-methylphenyl)sulfonylamino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [2-methoxy-5-[[2-methoxyethyl(tosyl)amino]methyl]phenyl] ester Formula: C24H26FNO7S2 MolecularWeight: 523.594143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H26FNO7S2/c1-18-4-9-21(10-5-18)34(27,28)26(14-15-31-2)17-19-6-13-23(32-3)24(16-19)33-35(29,30)22-11-7-20(25)8-12-22/h4-13,16H,14-15,17H2,1-3H3