3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-5-yl]benzenecarbonitrile

Systemtic Name: 3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-5-yl]benzenecarbonitrile Openeye Name: 3-(1,1,3-trioxo-1,2-benzothiazol-5-yl)benzonitrile CAS Name: 3-(1,1,3-trioxo-1,2-benzothiazol-5-yl)benzonitrile IUPAC Name: 3-(1,1,3-trioxo-1,2-benzothiazol-5-yl)benzonitrile Traditional Name: 3-(1,1,3-triketo-1,2-benzothiazol-5-yl)benzonitrile Formula: C14H8N2O3S MolecularWeight: 284.28992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CC3=C(C=C2)S(=O)(=O)NC3=O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=CC3=C(C=C2)S(=O)(=O)NC3=O)C#N

InChI

InChI=1S/C14H8N2O3S/c15-8-9-2-1-3-10(6-9)11-4-5-13-12(7-11)14(17)16-20(13,18)19/h1-7H,(H,16,17)