4-methyl-2-nitro-6-(1,2,3-thiadiazol-4-yl)phenolate

Systemtic Name: 4-methyl-2-nitro-6-(1,2,3-thiadiazol-4-yl)phenolate Openeye Name: 4-methyl-2-nitro-6-(thiadiazol-4-yl)phenolate CAS Name: 4-methyl-2-nitro-6-(4-thiadiazolyl)phenolate IUPAC Name: 4-methyl-2-nitro-6-(thiadiazol-4-yl)phenolate Traditional Name: 4-methyl-2-nitro-6-(thiadiazol-4-yl)phenolate Formula: C9H6N3O3S- MolecularWeight: 236.22724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CSN=N2)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CSN=N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N3O3S/c1-5-2-6(7-4-16-11-10-7)9(13)8(3-5)12(14)15/h2-4,13H,1H3/p-1