2-[2-dodecylpentadecyl(dimethyl)azaniumyl]-2-methyl-propanoate

Systemtic Name: 2-[2-dodecylpentadecyl(dimethyl)azaniumyl]-2-methyl-propanoate Openeye Name: 2-[2-dodecylpentadecyl(dimethyl)ammonio]-2-methyl-propanoate CAS Name: 2-[2-dodecylpentadecyl(dimethyl)ammonio]-2-methylpropanoate IUPAC Name: 2-[2-dodecylpentadecyl(dimethyl)azaniumyl]-2-methylpropanoate Traditional Name: 2-[2-laurylpentadecyl(dimethyl)ammonio]-2-methyl-propionate Formula: C33H67NO2 MolecularWeight: 509.89058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCCCCCCCCCCC)C[N+](C)(C)C(C)(C)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCC(CCCCCCCCCCCC)C[N+](C)(C)C(C)(C)C(=O)[O-]

InChI

InChI=1S/C33H67NO2/c1-7-9-11-13-15-17-19-21-23-25-27-29-31(30-34(5,6)33(3,4)32(35)36)28-26-24-22-20-18-16-14-12-10-8-2/h31H,7-30H2,1-6H3