(7-bromanyl-5-nitro-quinolin-8-yl) 1,2,3-thiadiazole-4-carboxylate

Systemtic Name: (7-bromanyl-5-nitro-quinolin-8-yl) 1,2,3-thiadiazole-4-carboxylate Openeye Name: (7-bromo-5-nitro-8-quinolyl) thiadiazole-4-carboxylate CAS Name: 4-thiadiazolecarboxylic acid (7-bromo-5-nitro-8-quinolinyl) ester IUPAC Name: (7-bromo-5-nitroquinolin-8-yl) thiadiazole-4-carboxylate Traditional Name: thiadiazole-4-carboxylic acid (7-bromo-5-nitro-8-quinolyl) ester Formula: C12H5BrN4O4S MolecularWeight: 381.1615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2[N+](=O)[O-])Br)OC(=O)C3=CSN=N3)N=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2[N+](=O)[O-])Br)OC(=O)C3=CSN=N3)N=C1

InChI

InChI=1S/C12H5BrN4O4S/c13-7-4-9(17(19)20)6-2-1-3-14-10(6)11(7)21-12(18)8-5-22-16-15-8/h1-5H