4-(2-hydroxyethyl)-4-methyl-2-[4-(2-methylpropylsulfonyl)phenyl]morpholin-4-ium-2-ol iodide

Systemtic Name: 4-(2-hydroxyethyl)-4-methyl-2-[4-(2-methylpropylsulfonyl)phenyl]morpholin-4-ium-2-ol iodide Openeye Name: 4-(2-hydroxyethyl)-2-(4-isobutylsulfonylphenyl)-4-methyl-morpholin-4-ium-2-ol iodide CAS Name: 4-(2-hydroxyethyl)-4-methyl-2-[4-(2-methylpropylsulfonyl)phenyl]-2-morpholin-4-iumol iodide IUPAC Name: 4-(2-hydroxyethyl)-4-methyl-2-[4-(2-methylpropylsulfonyl)phenyl]morpholin-4-ium-2-ol iodide Traditional Name: 4-(2-hydroxyethyl)-2-(4-isobutylsulfonylphenyl)-4-methyl-morpholin-4-ium-2-ol iodide Formula: C17H28INO5S MolecularWeight: 485.37739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=CC=C(C=C1)C2(C[N+](CCO2)(C)CCO)O.[I-]

Isomeric SMILES

CC(C)CS(=O)(=O)C1=CC=C(C=C1)C2(C[N+](CCO2)(C)CCO)O.[I-]

InChI

InChI=1S/C17H28NO5S.HI/c1-14(2)12-24(21,22)16-6-4-15(5-7-16)17(20)13-18(3,8-10-19)9-11-23-17;/h4-7,14,19-20H,8-13H2,1-3H3;1H/q+1;/p-1