2-(2H-1,2,3-benzothiadiazin-7-yl)-4-cyano-benzoic acid

Systemtic Name: 2-(2H-1,2,3-benzothiadiazin-7-yl)-4-cyano-benzoic acid Openeye Name: 2-(2H-1,2,3-benzothiadiazin-7-yl)-4-cyano-benzoic acid CAS Name: 2-(2H-1,2,3-benzothiadiazin-7-yl)-4-cyanobenzoic acid IUPAC Name: 2-(2H-1,2,3-benzothiadiazin-7-yl)-4-cyanobenzoic acid Traditional Name: 2-(2H-1,2,3-benzothiadiazin-7-yl)-4-cyano-benzoic acid Formula: C15H9N3O2S MolecularWeight: 295.31586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)C2=CC3=C(C=C2)C=NNS3)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)C2=CC3=C(C=C2)C=NNS3)C(=O)O

InChI

InChI=1S/C15H9N3O2S/c16-7-9-1-4-12(15(19)20)13(5-9)10-2-3-11-8-17-18-21-14(11)6-10/h1-6,8,18H,(H,19,20)