[7-(2,5-dimethoxyphenyl)-3-ethyl-7-oxidanyl-7-phenyl-heptan-3-yl]azanium iodide

Systemtic Name: [7-(2,5-dimethoxyphenyl)-3-ethyl-7-oxidanyl-7-phenyl-heptan-3-yl]azanium iodide Openeye Name: [5-(2,5-dimethoxyphenyl)-1,1-diethyl-5-hydroxy-5-phenyl-pentyl]ammonium iodide CAS Name: [7-(2,5-dimethoxyphenyl)-3-ethyl-7-hydroxy-7-phenylheptan-3-yl]ammonium iodide IUPAC Name: [7-(2,5-dimethoxyphenyl)-3-ethyl-7-hydroxy-7-phenylheptan-3-yl]azanium iodide Traditional Name: [5-(2,5-dimethoxyphenyl)-1,1-diethyl-5-hydroxy-5-phenyl-pentyl]ammonium iodide Formula: C23H34INO3 MolecularWeight: 499.42543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCC(C1=CC=CC=C1)(C2=C(C=CC(=C2)OC)OC)O)[NH3+].[I-]

Isomeric SMILES

CCC(CC)(CCCC(C1=CC=CC=C1)(C2=C(C=CC(=C2)OC)OC)O)[NH3+].[I-]

InChI

InChI=1S/C23H33NO3.HI/c1-5-22(24,6-2)15-10-16-23(25,18-11-8-7-9-12-18)20-17-19(26-3)13-14-21(20)27-4;/h7-9,11-14,17,25H,5-6,10,15-16,24H2,1-4H3;1H