trioctyl(1-phenylprop-2-enyl)azanium chloride

Systemtic Name: trioctyl(1-phenylprop-2-enyl)azanium chloride Openeye Name: trioctyl(1-phenylallyl)ammonium chloride CAS Name: trioctyl(1-phenylprop-2-enyl)ammonium chloride IUPAC Name: trioctyl(1-phenylprop-2-enyl)azanium chloride Traditional Name: trioctyl(1-phenylallyl)ammonium chloride Formula: C33H60ClN MolecularWeight: 506.2892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C(C=C)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C(C=C)C1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C33H60N.ClH/c1-5-9-12-15-18-24-29-34(30-25-19-16-13-10-6-2,31-26-20-17-14-11-7-3)33(8-4)32-27-22-21-23-28-32;/h8,21-23,27-28,33H,4-7,9-20,24-26,29-31H2,1-3H3;1H/q+1;/p-1