[4-[[2-methoxyethyl-(2-methoxyphenyl)carbonyl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-[[2-methoxyethyl-(2-methoxyphenyl)carbonyl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-[[(2-methoxybenzoyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-[[2-methoxyethyl-[(2-methoxyphenyl)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[(2-methoxybenzoyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-[[2-methoxyethyl(o-anisoyl)amino]methyl]phenyl] ester Formula: C24H24FNO6S MolecularWeight: 473.513863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3OC

Isomeric SMILES

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C24H24FNO6S/c1-30-16-15-26(24(27)22-5-3-4-6-23(22)31-2)17-18-7-11-20(12-8-18)32-33(28,29)21-13-9-19(25)10-14-21/h3-14H,15-17H2,1-2H3