2-oxidanylidene-3-phenyl-1-prop-2-enyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde

Systemtic Name: 2-oxidanylidene-3-phenyl-1-prop-2-enyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde Openeye Name: 1-allyl-2-oxo-3-phenyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde CAS Name: 2-oxo-3-phenyl-1-prop-2-enyl-5-(1-pyridin-1-iumyl)-4-imidazolecarboxaldehyde IUPAC Name: 2-oxo-3-phenyl-1-prop-2-enyl-5-pyridin-1-ium-1-ylimidazole-4-carbaldehyde Traditional Name: 1-allyl-2-keto-3-phenyl-5-pyridin-1-ium-1-yl-4-imidazoline-4-carbaldehyde Formula: C18H16N3O2+ MolecularWeight: 306.33854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(N(C1=O)C2=CC=CC=C2)C=O)[N+]3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=C(N(C1=O)C2=CC=CC=C2)C=O)[N+]3=CC=CC=C3

InChI

InChI=1S/C18H16N3O2/c1-2-11-20-17(19-12-7-4-8-13-19)16(14-22)21(18(20)23)15-9-5-3-6-10-15/h2-10,12-14H,1,11H2/q+1