1-(1-dodecylpyridin-1-ium-3-yl)pentan-1-one chloride

Systemtic Name: 1-(1-dodecylpyridin-1-ium-3-yl)pentan-1-one chloride Openeye Name: 1-(1-dodecylpyridin-1-ium-3-yl)pentan-1-one chloride CAS Name: 1-(1-dodecyl-3-pyridin-1-iumyl)-1-pentanone chloride IUPAC Name: 1-(1-dodecylpyridin-1-ium-3-yl)pentan-1-one chloride Traditional Name: 1-(1-laurylpyridin-1-ium-3-yl)pentan-1-one chloride Formula: C22H38ClNO MolecularWeight: 367.99622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)CCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)CCCC.[Cl-]

InChI

InChI=1S/C22H38NO.ClH/c1-3-5-7-8-9-10-11-12-13-14-18-23-19-15-16-21(20-23)22(24)17-6-4-2;/h15-16,19-20H,3-14,17-18H2,1-2H3;1H/q+1;/p-1