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

Systemtic Name: trimethyl-[(R)-[(1S,2R)-2-oxidanyl-2-(phenylmethyl)cyclohexyl]-phenyl-methyl]azanium iodide Openeye Name: [(R)-[(1S,2R)-2-benzyl-2-hydroxy-cyclohexyl]-phenyl-methyl]-trimethyl-ammonium iodide CAS Name: [(R)-[(1S,2R)-2-hydroxy-2-(phenylmethyl)cyclohexyl]-phenylmethyl]-trimethylammonium iodide IUPAC Name: [(R)-[(1S,2R)-2-benzyl-2-hydroxycyclohexyl]-phenylmethyl]-trimethylazanium iodide Traditional Name: [(R)-[(1S,2R)-2-benzyl-2-hydroxy-cyclohexyl]-phenyl-methyl]-trimethyl-ammonium iodide Formula: C23H32INO MolecularWeight: 465.41075

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(C1CCCCC1(CC2=CC=CC=C2)O)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+](C)(C)[C@H]([C@@H]1CCCC[C@]1(CC2=CC=CC=C2)O)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C23H32NO.HI/c1-24(2,3)22(20-14-8-5-9-15-20)21-16-10-11-17-23(21,25)18-19-12-6-4-7-13-19;/h4-9,12-15,21-22,25H,10-11,16-18H2,1-3H3;1H/q+1;/p-1/t21-,22-,23+;/m0./s1