carboxymethyl-dodecyl-dimethyl-azanium; 2-(trimethylazaniumyl)tetradecanoate

Systemtic Name: carboxymethyl-dodecyl-dimethyl-azanium; 2-(trimethylazaniumyl)tetradecanoate Openeye Name: carboxymethyl-dodecyl-dimethyl-ammonium; 2-(trimethylammonio)tetradecanoate CAS Name: carboxymethyl-dodecyl-dimethylammonium; 2-(trimethylammonio)tetradecanoate IUPAC Name: carboxymethyl-dodecyl-dimethylazanium; 2-(trimethylazaniumyl)tetradecanoate Traditional Name: carboxymethyl-lauryl-dimethyl-ammonium; 2-(trimethylammonio)myristate Formula: C33H69N2O4+ MolecularWeight: 557.91196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)[O-])[N+](C)(C)C.CCCCCCCCCCCC[N+](C)(C)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)[O-])[N+](C)(C)C.CCCCCCCCCCCC[N+](C)(C)CC(=O)O

InChI

InChI=1S/C17H35NO2.C16H33NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16(17(19)20)18(2,3)4;1-4-5-6-7-8-9-10-11-12-13-14-17(2,3)15-16(18)19/h16H,5-15H2,1-4H3;4-15H2,1-3H3/p+1