3-[(5E)-5-[(2E)-2-pyrrol-2-ylideneethylidene]-1H-pyrazol-2-yl]benzenecarbonitrile

Systemtic Name: 3-[(5E)-5-[(2E)-2-pyrrol-2-ylideneethylidene]-1H-pyrazol-2-yl]benzenecarbonitrile Openeye Name: 3-[(5E)-5-[(2E)-2-pyrrol-2-ylideneethylidene]-1H-pyrazol-2-yl]benzonitrile CAS Name: 3-[(5E)-5-[(2E)-2-(2-pyrrolylidene)ethylidene]-1H-pyrazol-2-yl]benzonitrile IUPAC Name: 3-[(5E)-5-[(2E)-2-pyrrol-2-ylideneethylidene]-1H-pyrazol-2-yl]benzonitrile Traditional Name: 3-[(3E)-3-[(2E)-2-pyrrol-2-ylideneethylidene]-3-pyrazolin-1-yl]benzonitrile Formula: C16H12N4 MolecularWeight: 260.29328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=CC(=CC=C3C=CC=N3)N2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)N2C=C/C(=C\C=C\3/C=CC=N3)/N2)C#N

InChI

InChI=1S/C16H12N4/c17-12-13-3-1-5-16(11-13)20-10-8-15(19-20)7-6-14-4-2-9-18-14/h1-11,19H/b14-6+,15-7+