3-dodecyl-2-(trimethylazaniumyl)hexadecanoate

Systemtic Name: 3-dodecyl-2-(trimethylazaniumyl)hexadecanoate Openeye Name: 3-dodecyl-2-(trimethylammonio)hexadecanoate CAS Name: 3-dodecyl-2-(trimethylammonio)hexadecanoate IUPAC Name: 3-dodecyl-2-(trimethylazaniumyl)hexadecanoate Traditional Name: 3-lauryl-2-(trimethylammonio)palmitate Formula: C31H63NO2 MolecularWeight: 481.83742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H63NO2/c1-6-8-10-12-14-16-18-20-22-24-26-28-29(30(31(33)34)32(3,4)5)27-25-23-21-19-17-15-13-11-9-7-2/h29-30H,6-28H2,1-5H3