pyridin-1-ium-1-ylmethyl octadecanoate

Systemtic Name: pyridin-1-ium-1-ylmethyl octadecanoate Openeye Name: pyridin-1-ium-1-ylmethyl octadecanoate CAS Name: octadecanoic acid 1-pyridin-1-iumylmethyl ester IUPAC Name: pyridin-1-ium-1-ylmethyl octadecanoate Traditional Name: stearic acid pyridin-1-ium-1-ylmethyl ester Formula: C24H42NO2+ MolecularWeight: 376.59578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC[N+]1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[N+]1=CC=CC=C1

InChI

InChI=1S/C24H42NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-24(26)27-23-25-21-18-16-19-22-25/h16,18-19,21-22H,2-15,17,20,23H2,1H3/q+1