diethyl 2-(1,2,3-benzothiadiazol-7-yl)propanedioate

Systemtic Name: diethyl 2-(1,2,3-benzothiadiazol-7-yl)propanedioate Openeye Name: diethyl 2-(1,2,3-benzothiadiazol-7-yl)propanedioate CAS Name: 2-(1,2,3-benzothiadiazol-7-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1,2,3-benzothiadiazol-7-yl)propanedioate Traditional Name: 2-(1,2,3-benzothiadiazol-7-yl)malonic acid diethyl ester Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C2C(=CC=C1)N=NS2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C2C(=CC=C1)N=NS2)C(=O)OCC

InChI

InChI=1S/C13H14N2O4S/c1-3-18-12(16)10(13(17)19-4-2)8-6-5-7-9-11(8)20-15-14-9/h5-7,10H,3-4H2,1-2H3