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

Systemtic Name: [4-[[2-methoxyethyl(2-phenylmethoxyethanoyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-[[(2-benzyloxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-[[2-methoxyethyl-(1-oxo-2-phenylmethoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[2-methoxyethyl-(2-phenylmethoxyacetyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-[[(2-benzoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C25H26FNO6S MolecularWeight: 487.540443

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)COCC3=CC=CC=C3

Isomeric SMILES

COCCN(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)COCC3=CC=CC=C3

InChI

InChI=1S/C25H26FNO6S/c1-31-16-15-27(25(28)19-32-18-21-5-3-2-4-6-21)17-20-7-11-23(12-8-20)33-34(29,30)24-13-9-22(26)10-14-24/h2-14H,15-19H2,1H3