[3-tetradecanoyloxy-2-(2,4,6-trimethylpyridin-1-ium-1-yl)propyl] tetradecanoate

Systemtic Name: [3-tetradecanoyloxy-2-(2,4,6-trimethylpyridin-1-ium-1-yl)propyl] tetradecanoate Openeye Name: [3-tetradecanoyloxy-2-(2,4,6-trimethylpyridin-1-ium-1-yl)propyl] tetradecanoate CAS Name: tetradecanoic acid [3-(1-oxotetradecoxy)-2-(2,4,6-trimethyl-1-pyridin-1-iumyl)propyl] ester IUPAC Name: [3-tetradecanoyloxy-2-(2,4,6-trimethylpyridin-1-ium-1-yl)propyl] tetradecanoate Traditional Name: myristic acid [3-tetradecanoyloxy-2-(2,4,6-trimethylpyridin-1-ium-1-yl)propyl] ester Formula: C39H70NO4+ MolecularWeight: 616.9774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC)[N+]1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC)[N+]1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C39H70NO4/c1-6-8-10-12-14-16-18-20-22-24-26-28-38(41)43-32-37(40-35(4)30-34(3)31-36(40)5)33-44-39(42)29-27-25-23-21-19-17-15-13-11-9-7-2/h30-31,37H,6-29,32-33H2,1-5H3/q+1