2-(cyclobutylmethyl)-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylic acid

Systemtic Name: 2-(cyclobutylmethyl)-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylic acid Openeye Name: 2-(cyclobutylmethyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid CAS Name: 2-(cyclobutylmethyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid IUPAC Name: 2-(cyclobutylmethyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid Traditional Name: 2-(cyclobutylmethyl)-1,1,3-triketo-1,2-benzothiazole-6-carboxylic acid Formula: C13H13NO5S MolecularWeight: 295.31102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)O

Isomeric SMILES

C1CC(C1)CN2C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)O

InChI

InChI=1S/C13H13NO5S/c15-12-10-5-4-9(13(16)17)6-11(10)20(18,19)14(12)7-8-2-1-3-8/h4-6,8H,1-3,7H2,(H,16,17)