2-[4,6-bis(oxidanylidene)-5-phenyl-1,3-diazinan-2-ylidene]propanedinitrile

Systemtic Name: 2-[4,6-bis(oxidanylidene)-5-phenyl-1,3-diazinan-2-ylidene]propanedinitrile Openeye Name: 2-(4,6-dioxo-5-phenyl-hexahydropyrimidin-2-ylidene)propanedinitrile CAS Name: 2-(4,6-dioxo-5-phenyl-1,3-diazinan-2-ylidene)propanedinitrile IUPAC Name: 2-(4,6-dioxo-5-phenyl-1,3-diazinan-2-ylidene)propanedinitrile Traditional Name: 2-(4,6-diketo-5-phenyl-hexahydropyrimidin-2-ylidene)malononitrile Formula: C13H8N4O2 MolecularWeight: 252.22822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)NC(=C(C#N)C#N)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)C2C(=O)NC(=C(C#N)C#N)NC2=O

InChI

InChI=1S/C13H8N4O2/c14-6-9(7-15)11-16-12(18)10(13(19)17-11)8-4-2-1-3-5-8/h1-5,10H,(H,16,18)(H,17,19)