1-[[2-[(2-methanoylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-carbaldehyde

Systemtic Name: 1-[[2-[(2-methanoylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-carbaldehyde Openeye Name: 1-[[2-[(2-formylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-carbaldehyde CAS Name: 1-[[2-[(2-formyl-1-pyridin-1-iumyl)methyl]phenyl]methyl]-2-pyridin-1-iumcarboxaldehyde IUPAC Name: 1-[[2-[(2-formylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-carbaldehyde Traditional Name: 1-[2-[(2-formylpyridin-1-ium-1-yl)methyl]benzyl]pyridin-1-ium-2-carbaldehyde Formula: C20H18N2O2+2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[N+]2=CC=CC=C2C=O)C[N+]3=CC=CC=C3C=O

Isomeric SMILES

C1=CC=C(C(=C1)C[N+]2=CC=CC=C2C=O)C[N+]3=CC=CC=C3C=O

InChI

InChI=1S/C20H18N2O2/c23-15-19-9-3-5-11-21(19)13-17-7-1-2-8-18(17)14-22-12-6-4-10-20(22)16-24/h1-12,15-16H,13-14H2/q+2