6-iodanyl-4-oxidanylidene-1,2-benzothiazine-3-carboxylic acid

Systemtic Name: 6-iodanyl-4-oxidanylidene-1,2-benzothiazine-3-carboxylic acid Openeye Name: 6-iodo-4-oxo-1,2-benzothiazine-3-carboxylic acid CAS Name: 6-iodo-4-oxo-1,2-benzothiazine-3-carboxylic acid IUPAC Name: 6-iodo-4-oxo-1,2-benzothiazine-3-carboxylic acid Traditional Name: 6-iodo-4-keto-1,2-benzothiazine-3-carboxylic acid Formula: C9H4INO3S MolecularWeight: 333.10243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1I)C(=O)C(=NS2)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1I)C(=O)C(=NS2)C(=O)O

InChI

InChI=1S/C9H4INO3S/c10-4-1-2-6-5(3-4)8(12)7(9(13)14)11-15-6/h1-3H,(H,13,14)