2-methyltridecan-2-yl(1-phenylethyl)azanium chloride

Systemtic Name: 2-methyltridecan-2-yl(1-phenylethyl)azanium chloride Openeye Name: 1,1-dimethyldodecyl(1-phenylethyl)ammonium chloride CAS Name: 2-methyltridecan-2-yl(1-phenylethyl)ammonium chloride IUPAC Name: 2-methyltridecan-2-yl(1-phenylethyl)azanium chloride Traditional Name: 1,1-dimethyldodecyl(1-phenylethyl)ammonium chloride Formula: C22H40ClN MolecularWeight: 354.0127

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H39N.ClH/c1-5-6-7-8-9-10-11-12-16-19-22(3,4)23-20(2)21-17-14-13-15-18-21;/h13-15,17-18,20,23H,5-12,16,19H2,1-4H3;1H