[4-[[ethanoyl(2-methylpropyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-[[ethanoyl(2-methylpropyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-[[acetyl(isobutyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-[[acetyl(2-methylpropyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[acetyl(2-methylpropyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-[[acetyl(isobutyl)amino]methyl]phenyl] ester Formula: C19H22FNO4S MolecularWeight: 379.445683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C

Isomeric SMILES

CC(C)CN(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C

InChI

InChI=1S/C19H22FNO4S/c1-14(2)12-21(15(3)22)13-16-4-8-18(9-5-16)25-26(23,24)19-10-6-17(20)7-11-19/h4-11,14H,12-13H2,1-3H3