4-[5-chloranyl-4,7-bis(oxidanylidene)-2,1,3-benzothiadiazol-6-yl]piperazine-1-carboxylic acid

Systemtic Name: 4-[5-chloranyl-4,7-bis(oxidanylidene)-2,1,3-benzothiadiazol-6-yl]piperazine-1-carboxylic acid Openeye Name: 4-(5-chloro-4,7-dioxo-2,1,3-benzothiadiazol-6-yl)piperazine-1-carboxylic acid CAS Name: 4-(5-chloro-4,7-dioxo-2,1,3-benzothiadiazol-6-yl)-1-piperazinecarboxylic acid IUPAC Name: 4-(5-chloro-4,7-dioxo-2,1,3-benzothiadiazol-6-yl)piperazine-1-carboxylic acid Traditional Name: 4-(6-chloro-4,7-diketo-piazthiol-5-yl)piperazine-1-carboxylic acid Formula: C11H9ClN4O4S MolecularWeight: 328.73156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)C3=NSN=C3C2=O)Cl)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)C3=NSN=C3C2=O)Cl)C(=O)O

InChI

InChI=1S/C11H9ClN4O4S/c12-5-8(15-1-3-16(4-2-15)11(19)20)10(18)7-6(9(5)17)13-21-14-7/h1-4H2,(H,19,20)