[4-[[(4-fluorophenyl)methyl-(furan-2-ylcarbonyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(4-fluorophenyl)methyl-(furan-2-ylcarbonyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(4-fluorophenyl)methyl-(furan-2-carbonyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(4-fluorophenyl)methyl-[2-furanyl(oxo)methyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[(4-fluorophenyl)methyl-(furan-2-carbonyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(4-fluorobenzyl)-(2-furoyl)amino]methyl]phenyl] ester Formula: C20H18FNO5S MolecularWeight: 403.424023

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)F)C(=O)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)F)C(=O)C3=CC=CO3

InChI

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