[3-[[butan-2-yl(phenylcarbonyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [3-[[butan-2-yl(phenylcarbonyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [3-[[benzoyl(sec-butyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [3-[[benzoyl(butan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [3-[[benzoyl(butan-2-yl)amino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [3-[[benzoyl(sec-butyl)amino]methyl]phenyl] ester Formula: C24H24FNO4S MolecularWeight: 441.515063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24FNO4S/c1-3-18(2)26(24(27)20-9-5-4-6-10-20)17-19-8-7-11-22(16-19)30-31(28,29)23-14-12-21(25)13-15-23/h4-16,18H,3,17H2,1-2H3