2-(2,1,3-benzothiadiazol-4-yliminomethyl)-4-bromanyl-6-nitro-phenolate

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-4-bromanyl-6-nitro-phenolate Openeye Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-4-bromo-6-nitro-phenolate CAS Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-4-bromo-6-nitrophenolate IUPAC Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-4-bromo-6-nitrophenolate Traditional Name: 4-bromo-2-nitro-6-(piazthiol-4-yliminomethyl)phenolate Formula: C13H6BrN4O3S- MolecularWeight: 378.18074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C13H7BrN4O3S/c14-8-4-7(13(19)11(5-8)18(20)21)6-15-9-2-1-3-10-12(9)17-22-16-10/h1-6,19H/p-1