2-[2-(2-methylnonadecan-2-yl)phenyl]propan-2-ylazanium chloride

Systemtic Name: 2-[2-(2-methylnonadecan-2-yl)phenyl]propan-2-ylazanium chloride Openeye Name: [1-[2-(1,1-dimethyloctadecyl)phenyl]-1-methyl-ethyl]ammonium chloride CAS Name: 2-[2-(2-methylnonadecan-2-yl)phenyl]propan-2-ylammonium chloride IUPAC Name: 2-[2-(2-methylnonadecan-2-yl)phenyl]propan-2-ylazanium chloride Traditional Name: [1-[2-(1,1-dimethyloctadecyl)phenyl]-1-methyl-ethyl]ammonium chloride Formula: C29H54ClN MolecularWeight: 452.19876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C)(C)C1=CC=CC=C1C(C)(C)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C)(C)C1=CC=CC=C1C(C)(C)[NH3+].[Cl-]

InChI

InChI=1S/C29H53N.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-28(2,3)26-23-20-21-24-27(26)29(4,5)30;/h20-21,23-24H,6-19,22,25,30H2,1-5H3;1H