[4-[[(4-fluorophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(4-fluorophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(4-fluorophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(4-fluorophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[(4-fluorophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(4-fluorophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C17H20FNO6S2 MolecularWeight: 417.472203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20FNO6S2/c1-24-12-11-19(27(22,23)17-9-5-15(18)6-10-17)13-14-3-7-16(8-4-14)25-26(2,20)21/h3-10H,11-13H2,1-2H3