2-[(1-oxidanylidenephthalazin-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(1-oxidanylidenephthalazin-2-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(1-oxophthalazin-2-yl)methyl]benzonitrile CAS Name: 2-[(1-oxo-2-phthalazinyl)methyl]benzonitrile IUPAC Name: 2-[(1-oxophthalazin-2-yl)methyl]benzonitrile Traditional Name: 2-[(1-ketophthalazin-2-yl)methyl]benzonitrile Formula: C16H11N3O MolecularWeight: 261.27804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CC3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CC3=CC=CC=C3C#N

InChI

InChI=1S/C16H11N3O/c17-9-12-5-1-2-7-14(12)11-19-16(20)15-8-4-3-6-13(15)10-18-19/h1-8,10H,11H2