3-oxidanylidene-5,6-dihydro-4H-4,7-phenanthroline-2-carbonitrile

Systemtic Name: 3-oxidanylidene-5,6-dihydro-4H-4,7-phenanthroline-2-carbonitrile Openeye Name: 3-oxo-5,6-dihydro-4H-4,7-phenanthroline-2-carbonitrile CAS Name: 3-oxo-5,6-dihydro-4H-4,7-phenanthroline-2-carbonitrile IUPAC Name: 3-oxo-5,6-dihydro-4H-4,7-phenanthroline-2-carbonitrile Traditional Name: 3-keto-5,6-dihydro-4H-4,7-phenanthroline-2-carbonitrile Formula: C13H9N3O MolecularWeight: 223.23006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=N2)C3=C1NC(=O)C(=C3)C#N

Isomeric SMILES

C1CC2=C(C=CC=N2)C3=C1NC(=O)C(=C3)C#N

InChI

InChI=1S/C13H9N3O/c14-7-8-6-10-9-2-1-5-15-11(9)3-4-12(10)16-13(8)17/h1-2,5-6H,3-4H2,(H,16,17)