2-methylpentadecan-2-yl-(phenylmethyl)azanium trichloride

Systemtic Name: 2-methylpentadecan-2-yl-(phenylmethyl)azanium trichloride Openeye Name: benzyl(1,1-dimethyltetradecyl)ammonium trichloride CAS Name: 2-methylpentadecan-2-yl-(phenylmethyl)ammonium trichloride IUPAC Name: benzyl(2-methylpentadecan-2-yl)azanium trichloride Traditional Name: benzyl(1,1-dimethyltetradecyl)ammonium trichloride Formula: C23H42Cl3N-2 MolecularWeight: 438.94528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C)(C)[NH2+]CC1=CC=CC=C1.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCC(C)(C)[NH2+]CC1=CC=CC=C1.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C23H41N.3ClH/c1-4-5-6-7-8-9-10-11-12-13-17-20-23(2,3)24-21-22-18-15-14-16-19-22;;;/h14-16,18-19,24H,4-13,17,20-21H2,1-3H3;3*1H/p-2