2-(2-tridecanoylphenyl)propan-2-ylazanium chloride

Systemtic Name: 2-(2-tridecanoylphenyl)propan-2-ylazanium chloride Openeye Name: [1-methyl-1-(2-tridecanoylphenyl)ethyl]ammonium chloride CAS Name: 2-[2-(1-oxotridecyl)phenyl]propan-2-ylammonium chloride IUPAC Name: 2-(2-tridecanoylphenyl)propan-2-ylazanium chloride Traditional Name: [1-methyl-1-(2-tridecanoylphenyl)ethyl]ammonium chloride Formula: C22H38ClNO MolecularWeight: 367.99622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H37NO.ClH/c1-4-5-6-7-8-9-10-11-12-13-18-21(24)19-16-14-15-17-20(19)22(2,3)23;/h14-17H,4-13,18,23H2,1-3H3;1H