dodecyl-dioctyl-(phenylmethyl)azanium chloride

Systemtic Name: dodecyl-dioctyl-(phenylmethyl)azanium chloride Openeye Name: benzyl-dodecyl-dioctyl-ammonium chloride CAS Name: dodecyl-dioctyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-dodecyl-dioctylazanium chloride Traditional Name: benzyl-lauryl-dioctyl-ammonium chloride Formula: C35H66ClN MolecularWeight: 536.35824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C35H66N.ClH/c1-4-7-10-13-16-17-18-19-22-28-33-36(31-26-20-14-11-8-5-2,32-27-21-15-12-9-6-3)34-35-29-24-23-25-30-35;/h23-25,29-30H,4-22,26-28,31-34H2,1-3H3;1H/q+1;/p-1