(1-hexylpyridin-1-ium-4-yl)-phenyl-methanone

Systemtic Name: (1-hexylpyridin-1-ium-4-yl)-phenyl-methanone Openeye Name: (1-hexylpyridin-1-ium-4-yl)-phenyl-methanone CAS Name: (1-hexyl-4-pyridin-1-iumyl)-phenylmethanone IUPAC Name: (1-hexylpyridin-1-ium-4-yl)-phenylmethanone Traditional Name: (1-hexylpyridin-1-ium-4-yl)-phenyl-methanone Formula: C18H22NO+ MolecularWeight: 268.37338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC[N+]1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H22NO/c1-2-3-4-8-13-19-14-11-17(12-15-19)18(20)16-9-6-5-7-10-16/h5-7,9-12,14-15H,2-4,8,13H2,1H3/q+1