2-ethanimidoyl-3-oxidanylidene-4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-(4-oxo-1,2,3-benzotriazin-3-yl)butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-(4-oxo-1,2,3-benzotriazin-3-yl)butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-(4-oxo-1,2,3-benzotriazin-3-yl)butanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-(4-keto-1,2,3-benzotriazin-3-yl)butyronitrile Formula: C13H11N5O2 MolecularWeight: 269.25874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(=N)C(C#N)C(=O)CN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H11N5O2/c1-8(15)10(6-14)12(19)7-18-13(20)9-4-2-3-5-11(9)16-17-18/h2-5,10,15H,7H2,1H3