2-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)propanedinitrile

Systemtic Name: 2-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)propanedinitrile Openeye Name: 2-(3-amino-5-oxo-1-phenyl-pyrazol-4-ylidene)propanedinitrile CAS Name: 2-(3-amino-5-oxo-1-phenyl-4-pyrazolylidene)propanedinitrile IUPAC Name: 2-(3-amino-5-oxo-1-phenylpyrazol-4-ylidene)propanedinitrile Traditional Name: 2-(3-amino-5-keto-1-phenyl-2-pyrazolin-4-ylidene)malononitrile Formula: C12H7N5O MolecularWeight: 237.21688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(C#N)C#N)C(=N2)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(C#N)C#N)C(=N2)N

InChI

InChI=1S/C12H7N5O/c13-6-8(7-14)10-11(15)16-17(12(10)18)9-4-2-1-3-5-9/h1-5H,(H2,15,16)