pyridin-1-ium-1-ylmethyl hexadecanoate chloride

Systemtic Name: pyridin-1-ium-1-ylmethyl hexadecanoate chloride Openeye Name: pyridin-1-ium-1-ylmethyl hexadecanoate chloride CAS Name: hexadecanoic acid 1-pyridin-1-iumylmethyl ester chloride IUPAC Name: pyridin-1-ium-1-ylmethyl hexadecanoate chloride Traditional Name: palmitic acid pyridin-1-ium-1-ylmethyl ester chloride Formula: C22H38ClNO2 MolecularWeight: 383.99562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC[N+]1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[N+]1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C22H38NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-22(24)25-21-23-19-16-14-17-20-23;/h14,16-17,19-20H,2-13,15,18,21H2,1H3;1H/q+1;/p-1