[2-methoxy-5-[[2-methoxyethyl-[3-(trifluoromethyl)phenyl]carbonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [2-methoxy-5-[[2-methoxyethyl-[3-(trifluoromethyl)phenyl]carbonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [2-methoxy-5-[[2-methoxyethyl-[3-(trifluoromethyl)benzoyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-methoxy-5-[[2-methoxyethyl-[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[2-methoxyethyl-[3-(trifluoromethyl)benzoyl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-methoxy-5-[[2-methoxyethyl-[3-(trifluoromethyl)benzoyl]amino]methyl]phenyl] ester Formula: C20H22F3NO6S MolecularWeight: 461.45199

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22F3NO6S/c1-28-10-9-24(19(25)15-5-4-6-16(12-15)20(21,22)23)13-14-7-8-17(29-2)18(11-14)30-31(3,26)27/h4-8,11-12H,9-10,13H2,1-3H3