2-[2-(1-decylpyridin-1-ium-2-yl)ethylcarbamoyloxy]ethyl 2-methylpropanoate

Systemtic Name: 2-[2-(1-decylpyridin-1-ium-2-yl)ethylcarbamoyloxy]ethyl 2-methylpropanoate Openeye Name: 2-[2-(1-decylpyridin-1-ium-2-yl)ethylcarbamoyloxy]ethyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid 2-[[2-(1-decyl-2-pyridin-1-iumyl)ethylamino]-oxomethoxy]ethyl ester IUPAC Name: 2-[2-(1-decylpyridin-1-ium-2-yl)ethylcarbamoyloxy]ethyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid 2-[2-(1-decylpyridin-1-ium-2-yl)ethylcarbamoyloxy]ethyl ester Formula: C24H41N2O4+ MolecularWeight: 421.59334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=CC=C1CCNC(=O)OCCOC(=O)C(C)C

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=CC=C1CCNC(=O)OCCOC(=O)C(C)C

InChI

InChI=1S/C24H40N2O4/c1-4-5-6-7-8-9-10-12-17-26-18-13-11-14-22(26)15-16-25-24(28)30-20-19-29-23(27)21(2)3/h11,13-14,18,21H,4-10,12,15-17,19-20H2,1-3H3/p+1