trimethyl-[(R)-[(1S,2S)-2-methyl-2-oxidanyl-cyclohexyl]-phenyl-methyl]azanium iodide

Systemtic Name: trimethyl-[(R)-[(1S,2S)-2-methyl-2-oxidanyl-cyclohexyl]-phenyl-methyl]azanium iodide Openeye Name: [(R)-[(1S,2S)-2-hydroxy-2-methyl-cyclohexyl]-phenyl-methyl]-trimethyl-ammonium iodide CAS Name: [(R)-[(1S,2S)-2-hydroxy-2-methylcyclohexyl]-phenylmethyl]-trimethylammonium iodide IUPAC Name: [(R)-[(1S,2S)-2-hydroxy-2-methylcyclohexyl]-phenylmethyl]-trimethylazanium iodide Traditional Name: [(R)-[(1S,2S)-2-hydroxy-2-methyl-cyclohexyl]-phenyl-methyl]-trimethyl-ammonium iodide Formula: C17H28INO MolecularWeight: 389.31479

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1C(C2=CC=CC=C2)[N+](C)(C)C)O.[I-]

Isomeric SMILES

C[C@@]1(CCCC[C@H]1[C@H](C2=CC=CC=C2)[N+](C)(C)C)O.[I-]

InChI

InChI=1S/C17H28NO.HI/c1-17(19)13-9-8-12-15(17)16(18(2,3)4)14-10-6-5-7-11-14;/h5-7,10-11,15-16,19H,8-9,12-13H2,1-4H3;1H/q+1;/p-1/t15-,16-,17-;/m0./s1