3-[(E)-[(5E)-5-[(3-cyanophenyl)methylidene]-4-oxidanylidene-1-pyridin-1-ium-2-yl-piperidin-3-ylidene]methyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-[(5E)-5-[(3-cyanophenyl)methylidene]-4-oxidanylidene-1-pyridin-1-ium-2-yl-piperidin-3-ylidene]methyl]benzenecarbonitrile Openeye Name: 3-[(E)-[(5E)-5-[(3-cyanophenyl)methylene]-4-oxo-1-pyridin-1-ium-2-yl-3-piperidylidene]methyl]benzonitrile CAS Name: 3-[(E)-[(5E)-5-[(3-cyanophenyl)methylidene]-4-oxo-1-(2-pyridin-1-iumyl)-3-piperidinylidene]methyl]benzonitrile IUPAC Name: 3-[(E)-[(5E)-5-[(3-cyanophenyl)methylidene]-4-oxo-1-pyridin-1-ium-2-ylpiperidin-3-ylidene]methyl]benzonitrile Traditional Name: 3-[(E)-[(5E)-5-(3-cyanobenzylidene)-4-keto-1-pyridin-1-ium-2-yl-3-piperidylidene]methyl]benzonitrile Formula: C26H19N4O+ MolecularWeight: 403.45526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CC(=C2)C#N)C(=O)C(=CC3=CC=CC(=C3)C#N)CN1C4=CC=CC=[NH+]4

Isomeric SMILES

C\1N(C/C(=C\C2=CC=CC(=C2)C#N)/C(=O)/C1=C/C3=CC=CC(=C3)C#N)C4=CC=CC=[NH+]4

InChI

InChI=1S/C26H18N4O/c27-15-21-7-3-5-19(11-21)13-23-17-30(25-9-1-2-10-29-25)18-24(26(23)31)14-20-6-4-8-22(12-20)16-28/h1-14H,17-18H2/p+1/b23-13+,24-14+