1-azabicyclo[2.2.2]octan-3-yl 2,4-bis(chloranyl)-5-methyl-benzenesulfonate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 2,4-bis(chloranyl)-5-methyl-benzenesulfonate Openeye Name: quinuclidin-3-yl 2,4-dichloro-5-methyl-benzenesulfonate CAS Name: 2,4-dichloro-5-methylbenzenesulfonic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2,4-dichloro-5-methylbenzenesulfonate Traditional Name: 2,4-dichloro-5-methyl-benzenesulfonic acid quinuclidin-3-yl ester Formula: C14H17Cl2NO3S MolecularWeight: 350.26068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)OC2CN3CCC2CC3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)OC2CN3CCC2CC3

InChI

InChI=1S/C14H17Cl2NO3S/c1-9-6-14(12(16)7-11(9)15)21(18,19)20-13-8-17-4-2-10(13)3-5-17/h6-7,10,13H,2-5,8H2,1H3