[2-decanoyloxy-4-[2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl]phenyl] decanoate

Systemtic Name: [2-decanoyloxy-4-[2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl]phenyl] decanoate Openeye Name: [2-decanoyloxy-4-[2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl]phenyl] decanoate CAS Name: decanoic acid [2-(1-oxodecoxy)-4-[2-(2,4,6-trimethyl-1-pyridin-1-iumyl)ethyl]phenyl] ester IUPAC Name: [2-decanoyloxy-4-[2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl]phenyl] decanoate Traditional Name: capric acid [2-capryloxy-4-[2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl]phenyl] ester Formula: C36H56NO4+ MolecularWeight: 566.83414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)CC[N+]2=C(C=C(C=C2C)C)C)OC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)CC[N+]2=C(C=C(C=C2C)C)C)OC(=O)CCCCCCCCC

InChI

InChI=1S/C36H56NO4/c1-6-8-10-12-14-16-18-20-35(38)40-33-23-22-32(24-25-37-30(4)26-29(3)27-31(37)5)28-34(33)41-36(39)21-19-17-15-13-11-9-7-2/h22-23,26-28H,6-21,24-25H2,1-5H3/q+1