[2-[[(3-fluorophenyl)carbonyl-(furan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [2-[[(3-fluorophenyl)carbonyl-(furan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [2-[[(3-fluorobenzoyl)-(2-furylmethyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-[[[(3-fluorophenyl)-oxomethyl]-(2-furanylmethyl)amino]methyl]phenyl] ester IUPAC Name: [2-[[(3-fluorobenzoyl)-(furan-2-ylmethyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[[(3-fluorobenzoyl)-(2-furfuryl)amino]methyl]phenyl] ester Formula: C20H18FNO5S MolecularWeight: 403.424023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=CC=C1CN(CC2=CC=CO2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC=C1CN(CC2=CC=CO2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H18FNO5S/c1-28(24,25)27-19-10-3-2-6-16(19)13-22(14-18-9-5-11-26-18)20(23)15-7-4-8-17(21)12-15/h2-12H,13-14H2,1H3