3-oxidanylidene-4H-4,7-phenanthroline-2-carbonitrile

Systemtic Name: 3-oxidanylidene-4H-4,7-phenanthroline-2-carbonitrile Openeye Name: 3-oxo-4H-4,7-phenanthroline-2-carbonitrile CAS Name: 3-oxo-4H-4,7-phenanthroline-2-carbonitrile IUPAC Name: 3-oxo-4H-4,7-phenanthroline-2-carbonitrile Traditional Name: 3-keto-4H-4,7-phenanthroline-2-carbonitrile Formula: C13H7N3O MolecularWeight: 221.21418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C=C(C(=O)N3)C#N)N=C1

Isomeric SMILES

C1=CC2=C(C=CC3=C2C=C(C(=O)N3)C#N)N=C1

InChI

InChI=1S/C13H7N3O/c14-7-8-6-10-9-2-1-5-15-11(9)3-4-12(10)16-13(8)17/h1-6H,(H,16,17)