[4-[4-(trifluoromethyl)phenoxy]piperidin-1-yl] 2-methyl-1-(oxidanylamino)-1-oxidanylidene-propane-2-sulfinate

Systemtic Name: [4-[4-(trifluoromethyl)phenoxy]piperidin-1-yl] 2-methyl-1-(oxidanylamino)-1-oxidanylidene-propane-2-sulfinate Openeye Name: [4-[4-(trifluoromethyl)phenoxy]-1-piperidyl] 1-(hydroxyamino)-2-methyl-1-oxo-propane-2-sulfinate CAS Name: 1-(hydroxyamino)-2-methyl-1-oxo-2-propanesulfinic acid IUPAC Name: [4-[4-(trifluoromethyl)phenoxy]piperidin-1-yl] 1-(hydroxyamino)-2-methyl-1-oxopropane-2-sulfinate Traditional Name: 1-(hydroxyamino)-1-keto-2-methyl-propane-2-sulfinic acid [4-[4-(trifluoromethyl)phenoxy]piperidino] ester Formula: C16H21F3N2O5S MolecularWeight: 410.40855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NO)S(=O)ON1CCC(CC1)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)NO)S(=O)ON1CCC(CC1)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O5S/c1-15(2,14(22)20-23)27(24)26-21-9-7-13(8-10-21)25-12-5-3-11(4-6-12)16(17,18)19/h3-6,13,23H,7-10H2,1-2H3,(H,20,22)