2-[2-nonadecanoyloxyethyl-[3-(4-nonan-5-ylpyridin-1-ium-1-yl)propanoyl]amino]ethyl nonadecanoate

Systemtic Name: 2-[2-nonadecanoyloxyethyl-[3-(4-nonan-5-ylpyridin-1-ium-1-yl)propanoyl]amino]ethyl nonadecanoate Openeye Name: 2-[3-[4-(1-butylpentyl)pyridin-1-ium-1-yl]propanoyl-(2-nonadecanoyloxyethyl)amino]ethyl nonadecanoate CAS Name: nonadecanoic acid 2-[[3-(4-nonan-5-yl-1-pyridin-1-iumyl)-1-oxopropyl]-[2-(1-oxononadecoxy)ethyl]amino]ethyl ester IUPAC Name: 2-[2-nonadecanoyloxyethyl-[3-(4-nonan-5-ylpyridin-1-ium-1-yl)propanoyl]amino]ethyl nonadecanoate Traditional Name: nonadecanoic acid 2-[3-[4-(1-butylpentyl)pyridin-1-ium-1-yl]propanoyl-(2-nonadecanoyloxyethyl)amino]ethyl ester Formula: C59H109N2O5+ MolecularWeight: 926.50716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCCCCCCCCC)C(=O)CC[N+]1=CC=C(C=C1)C(CCCC)CCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCCCCCCCCC)C(=O)CC[N+]1=CC=C(C=C1)C(CCCC)CCCC

InChI

InChI=1S/C59H109N2O5/c1-5-9-13-15-17-19-21-23-25-27-29-31-33-35-37-39-43-58(63)65-53-51-61(57(62)47-50-60-48-45-56(46-49-60)55(41-11-7-3)42-12-8-4)52-54-66-59(64)44-40-38-36-34-32-30-28-26-24-22-20-18-16-14-10-6-2/h45-46,48-49,55H,5-44,47,50-54H2,1-4H3/q+1