[4-chloranyl-1-[4-(2-hydroxyethyl)phenyl]-5,5-dimethyl-cyclohex-3-en-1-yl]sulfonyl-cyclobutyl-dimethyl-azanium

Systemtic Name: [4-chloranyl-1-[4-(2-hydroxyethyl)phenyl]-5,5-dimethyl-cyclohex-3-en-1-yl]sulfonyl-cyclobutyl-dimethyl-azanium Openeye Name: [4-chloro-1-[4-(2-hydroxyethyl)phenyl]-5,5-dimethyl-cyclohex-3-en-1-yl]sulfonyl-cyclobutyl-dimethyl-ammonium CAS Name: [4-chloro-1-[4-(2-hydroxyethyl)phenyl]-5,5-dimethyl-1-cyclohex-3-enyl]sulfonyl-cyclobutyl-dimethylammonium IUPAC Name: [4-chloro-1-[4-(2-hydroxyethyl)phenyl]-5,5-dimethylcyclohex-3-en-1-yl]sulfonyl-cyclobutyl-dimethylazanium Traditional Name: [4-chloro-1-[4-(2-hydroxyethyl)phenyl]-5,5-dimethyl-cyclohex-3-en-1-yl]sulfonyl-cyclobutyl-dimethyl-ammonium Formula: C22H33ClNO3S+ MolecularWeight: 427.02032

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC=C1Cl)(C2=CC=C(C=C2)CCO)S(=O)(=O)[N+](C)(C)C3CCC3)C

Isomeric SMILES

CC1(CC(CC=C1Cl)(C2=CC=C(C=C2)CCO)S(=O)(=O)[N+](C)(C)C3CCC3)C

InChI

InChI=1S/C22H33ClNO3S/c1-21(2)16-22(14-12-20(21)23,18-10-8-17(9-11-18)13-15-25)28(26,27)24(3,4)19-6-5-7-19/h8-12,19,25H,5-7,13-16H2,1-4H3/q+1