1-(4-dodecylphenyl)-2-pyridin-1-ium-1-yl-ethanone

Systemtic Name: 1-(4-dodecylphenyl)-2-pyridin-1-ium-1-yl-ethanone Openeye Name: 1-(4-dodecylphenyl)-2-pyridin-1-ium-1-yl-ethanone CAS Name: 1-(4-dodecylphenyl)-2-(1-pyridin-1-iumyl)ethanone IUPAC Name: 1-(4-dodecylphenyl)-2-pyridin-1-ium-1-ylethanone Traditional Name: 1-(4-laurylphenyl)-2-pyridin-1-ium-1-yl-ethanone Formula: C25H36NO+ MolecularWeight: 366.55944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2

InChI

InChI=1S/C25H36NO/c1-2-3-4-5-6-7-8-9-10-12-15-23-16-18-24(19-17-23)25(27)22-26-20-13-11-14-21-26/h11,13-14,16-21H,2-10,12,15,22H2,1H3/q+1