7-nitro-1,2-benzothiazole-3-carboxylic acid

Systemtic Name: 7-nitro-1,2-benzothiazole-3-carboxylic acid Openeye Name: 7-nitro-1,2-benzothiazole-3-carboxylic acid CAS Name: 7-nitro-1,2-benzothiazole-3-carboxylic acid IUPAC Name: 7-nitro-1,2-benzothiazole-3-carboxylic acid Traditional Name: 7-nitro-1,2-benzothiazole-3-carboxylic acid Formula: C8H4N2O4S MolecularWeight: 224.19336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SN=C2C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SN=C2C(=O)O

InChI

InChI=1S/C8H4N2O4S/c11-8(12)6-4-2-1-3-5(10(13)14)7(4)15-9-6/h1-3H,(H,11,12)