6-[bis(azanyl)methylidene]-2-oxidanylidene-naphthalene-1-carboxylic acid; methanesulfonate

Systemtic Name: 6-[bis(azanyl)methylidene]-2-oxidanylidene-naphthalene-1-carboxylic acid; methanesulfonate Openeye Name: 6-(diaminomethylene)-2-oxo-naphthalene-1-carboxylic acid; methanesulfonate CAS Name: 6-(diaminomethylidene)-2-oxo-1-naphthalenecarboxylic acid; methanesulfonate IUPAC Name: 6-(diaminomethylidene)-2-oxonaphthalene-1-carboxylic acid; methanesulfonate Traditional Name: 6-(diaminomethylene)-2-keto-1-naphthoic acid mesylate Formula: C13H13N2O6S- MolecularWeight: 325.31712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC(=O)C(=C2C1=CC(=C(N)N)C=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC(=O)C(=C2C1=CC(=C(N)N)C=C2)C(=O)O

InChI

InChI=1S/C12H10N2O3.CH4O3S/c13-11(14)7-1-3-8-6(5-7)2-4-9(15)10(8)12(16)17;1-5(2,3)4/h1-5H,13-14H2,(H,16,17);1H3,(H,2,3,4)/p-1