methyl 1,2,3-benzothiadiazole-4-carboxylate

Systemtic Name: methyl 1,2,3-benzothiadiazole-4-carboxylate Openeye Name: methyl 1,2,3-benzothiadiazole-4-carboxylate CAS Name: 1,2,3-benzothiadiazole-4-carboxylic acid methyl ester IUPAC Name: methyl 1,2,3-benzothiadiazole-4-carboxylate Traditional Name: 1,2,3-benzothiadiazole-4-carboxylic acid methyl ester Formula: C8H6N2O2S MolecularWeight: 194.21044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)SN=N2

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)SN=N2

InChI

InChI=1S/C8H6N2O2S/c1-12-8(11)5-3-2-4-6-7(5)9-10-13-6/h2-4H,1H3