2-(2,1,3-benzothiadiazol-4-yliminomethyl)-5-methyl-phenolate

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-5-methyl-phenolate Openeye Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-5-methyl-phenolate CAS Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-5-methylphenolate IUPAC Name: 2-(2,1,3-benzothiadiazol-4-yliminomethyl)-5-methylphenolate Traditional Name: 5-methyl-2-(piazthiol-4-yliminomethyl)phenolate Formula: C14H10N3OS- MolecularWeight: 268.3137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=NC2=CC=CC3=NSN=C32)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C=NC2=CC=CC3=NSN=C32)[O-]

InChI

InChI=1S/C14H11N3OS/c1-9-5-6-10(13(18)7-9)8-15-11-3-2-4-12-14(11)17-19-16-12/h2-8,18H,1H3/p-1