5-(3-oxidanyl-3,3-diphenyl-propyl)nonan-5-ylazanium iodide

Systemtic Name: 5-(3-oxidanyl-3,3-diphenyl-propyl)nonan-5-ylazanium iodide Openeye Name: [1-butyl-1-(3-hydroxy-3,3-diphenyl-propyl)pentyl]ammonium iodide CAS Name: 5-(3-hydroxy-3,3-diphenylpropyl)nonan-5-ylammonium iodide IUPAC Name: 5-(3-hydroxy-3,3-diphenylpropyl)nonan-5-ylazanium iodide Traditional Name: [1-butyl-1-(3-hydroxy-3,3-diphenyl-propyl)pentyl]ammonium iodide Formula: C24H36INO MolecularWeight: 481.45321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H35NO.HI/c1-3-5-17-23(25,18-6-4-2)19-20-24(26,21-13-9-7-10-14-21)22-15-11-8-12-16-22;/h7-16,26H,3-6,17-20,25H2,1-2H3;1H