4-[[[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(1,4-dioxo-2,3-dihydrophthalazin-5-yl)amino]methyl]benzonitrile CAS Name: 4-[[(1,4-dioxo-2,3-dihydrophthalazin-5-yl)amino]methyl]benzonitrile IUPAC Name: 4-[[(1,4-dioxo-2,3-dihydrophthalazin-5-yl)amino]methyl]benzonitrile Traditional Name: 4-[[(1,4-diketo-2,3-dihydrophthalazin-5-yl)amino]methyl]benzonitrile Formula: C16H12N4O2 MolecularWeight: 292.29208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NCC3=CC=C(C=C3)C#N)C(=O)NNC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)NCC3=CC=C(C=C3)C#N)C(=O)NNC2=O

InChI

InChI=1S/C16H12N4O2/c17-8-10-4-6-11(7-5-10)9-18-13-3-1-2-12-14(13)16(22)20-19-15(12)21/h1-7,18H,9H2,(H,19,21)(H,20,22)