5-azanyl-4-oxidanylidene-3,7-diphenyl-phthalazine-6-carbonitrile

Systemtic Name: 5-azanyl-4-oxidanylidene-3,7-diphenyl-phthalazine-6-carbonitrile Openeye Name: 5-amino-4-oxo-3,7-diphenyl-phthalazine-6-carbonitrile CAS Name: 5-amino-4-oxo-3,7-diphenyl-6-phthalazinecarbonitrile IUPAC Name: 5-amino-4-oxo-3,7-diphenylphthalazine-6-carbonitrile Traditional Name: 5-amino-4-keto-3,7-diphenyl-phthalazine-6-carbonitrile Formula: C21H14N4O MolecularWeight: 338.36206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C3C(=C2)C=NN(C3=O)C4=CC=CC=C4)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C3C(=C2)C=NN(C3=O)C4=CC=CC=C4)N)C#N

InChI

InChI=1S/C21H14N4O/c22-12-18-17(14-7-3-1-4-8-14)11-15-13-24-25(16-9-5-2-6-10-16)21(26)19(15)20(18)23/h1-11,13H,23H2