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

Systemtic Name: 4-[[3,5-bis(oxidanylidene)-1,2,4-triazinan-2-yl]methyl]benzenecarbonitrile Openeye Name: 4-[(3,5-dioxo-1,2,4-triazinan-2-yl)methyl]benzonitrile CAS Name: 4-[(3,5-dioxo-1,2,4-triazinan-2-yl)methyl]benzonitrile IUPAC Name: 4-[(3,5-dioxo-1,2,4-triazinan-2-yl)methyl]benzonitrile Traditional Name: 4-[(3,5-diketo-1,2,4-triazinan-2-yl)methyl]benzonitrile Formula: C11H10N4O2 MolecularWeight: 230.2227

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(=O)N(N1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

C1C(=O)NC(=O)N(N1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C11H10N4O2/c12-5-8-1-3-9(4-2-8)7-15-11(17)14-10(16)6-13-15/h1-4,13H,6-7H2,(H,14,16,17)