methyl benzo[e][1,2,3]benzothiadiazole-4-carboxylate

Systemtic Name: methyl benzo[e][1,2,3]benzothiadiazole-4-carboxylate Openeye Name: methyl benzo[e][1,2,3]benzothiadiazole-4-carboxylate CAS Name: 4-benzo[e][1,2,3]benzothiadiazolecarboxylic acid methyl ester IUPAC Name: methyl benzo[e][1,2,3]benzothiadiazole-4-carboxylate Traditional Name: benzo[e][1,2,3]benzothiadiazole-4-carboxylic acid methyl ester Formula: C12H8N2O2S MolecularWeight: 244.26912

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC=CC=C2C3=C1SN=N3

Isomeric SMILES

COC(=O)C1=CC2=CC=CC=C2C3=C1SN=N3

InChI

InChI=1S/C12H8N2O2S/c1-16-12(15)9-6-7-4-2-3-5-8(7)10-11(9)17-14-13-10/h2-6H,1H3