4-(3-oxidanyl-3,3-diphenyl-propyl)hepta-1,6-dien-4-ylazanium iodide

Systemtic Name: 4-(3-oxidanyl-3,3-diphenyl-propyl)hepta-1,6-dien-4-ylazanium iodide Openeye Name: [1-allyl-1-(3-hydroxy-3,3-diphenyl-propyl)but-3-enyl]ammonium iodide CAS Name: 4-(3-hydroxy-3,3-diphenylpropyl)hepta-1,6-dien-4-ylammonium iodide IUPAC Name: 4-(3-hydroxy-3,3-diphenylpropyl)hepta-1,6-dien-4-ylazanium iodide Traditional Name: [1-allyl-1-(3-hydroxy-3,3-diphenyl-propyl)but-3-enyl]ammonium iodide Formula: C22H28INO MolecularWeight: 449.36829

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO.HI/c1-3-15-21(23,16-4-2)17-18-22(24,19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h3-14,24H,1-2,15-18,23H2;1H