2-[6,7-bis(chloranyl)-1-oxidanyl-3-oxidanylidene-4H-1,2,4-benzotriazin-2-yl]benzenecarbonitrile

Systemtic Name: 2-[6,7-bis(chloranyl)-1-oxidanyl-3-oxidanylidene-4H-1,2,4-benzotriazin-2-yl]benzenecarbonitrile Openeye Name: 2-(6,7-dichloro-1-hydroxy-3-oxo-4H-1,2,4-benzotriazin-2-yl)benzonitrile CAS Name: 2-(6,7-dichloro-1-hydroxy-3-oxo-4H-1,2,4-benzotriazin-2-yl)benzonitrile IUPAC Name: 2-(6,7-dichloro-1-hydroxy-3-oxo-4H-1,2,4-benzotriazin-2-yl)benzonitrile Traditional Name: 2-(6,7-dichloro-1-hydroxy-3-keto-4H-1,2,4-benzotriazin-2-yl)benzonitrile Formula: C14H8Cl2N4O2 MolecularWeight: 335.14492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)N2C(=O)NC3=CC(=C(C=C3N2O)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C#N)N2C(=O)NC3=CC(=C(C=C3N2O)Cl)Cl

InChI

InChI=1S/C14H8Cl2N4O2/c15-9-5-11-13(6-10(9)16)20(22)19(14(21)18-11)12-4-2-1-3-8(12)7-17/h1-6,22H,(H,18,21)