6-[(2-phenylcyclohexa-1,3-dien-1-yl)methyl]-2H-pyridin-1-ium 1-oxide

Systemtic Name: 6-[(2-phenylcyclohexa-1,3-dien-1-yl)methyl]-2H-pyridin-1-ium 1-oxide Openeye Name: 6-[(2-phenylcyclohexa-1,3-dien-1-yl)methyl]-2H-pyridin-1-ium 1-oxide CAS Name: 6-[(2-phenyl-1-cyclohexa-1,3-dienyl)methyl]-2H-pyridin-1-ium 1-oxide IUPAC Name: 6-[(2-phenylcyclohexa-1,3-dien-1-yl)methyl]-2H-pyridin-1-ium 1-oxide Traditional Name: 6-[(2-phenylcyclohexa-1,3-dien-1-yl)methyl]-2H-pyridin-1-ium 1-oxide Formula: C18H18NO+ MolecularWeight: 264.34162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C=C1)C2=CC=CC=C2)CC3=CC=CC[N+]3=O

Isomeric SMILES

C1CC(=C(C=C1)C2=CC=CC=C2)CC3=CC=CC[N+]3=O

InChI

InChI=1S/C18H18NO/c20-19-13-7-6-11-17(19)14-16-10-4-5-12-18(16)15-8-2-1-3-9-15/h1-3,5-9,11-12H,4,10,13-14H2/q+1