2-pyridin-1-ium-1-ylethyl dodecanoate bromide

Systemtic Name: 2-pyridin-1-ium-1-ylethyl dodecanoate bromide Openeye Name: 2-pyridin-1-ium-1-ylethyl dodecanoate bromide CAS Name: dodecanoic acid 2-(1-pyridin-1-iumyl)ethyl ester bromide IUPAC Name: 2-pyridin-1-ium-1-ylethyl dodecanoate bromide Traditional Name: lauric acid 2-pyridin-1-ium-1-ylethyl ester bromide Formula: C19H32BrNO2 MolecularWeight: 386.36688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC[N+]1=CC=CC=C1.[Br-]

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC[N+]1=CC=CC=C1.[Br-]

InChI

InChI=1S/C19H32NO2.BrH/c1-2-3-4-5-6-7-8-9-11-14-19(21)22-18-17-20-15-12-10-13-16-20;/h10,12-13,15-16H,2-9,11,14,17-18H2,1H3;1H/q+1;/p-1