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

Systemtic Name: 4-chloranyl-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]benzenecarbonitrile Openeye Name: 4-chloro-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)benzonitrile CAS Name: 4-chloro-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)benzonitrile IUPAC Name: 4-chloro-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)benzonitrile Traditional Name: 4-chloro-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)benzonitrile Formula: C14H7ClN2O3S MolecularWeight: 318.73498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)C3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)C3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C14H7ClN2O3S/c15-10-6-5-9(8-16)12(7-10)17-14(18)11-3-1-2-4-13(11)21(17,19)20/h1-7H