4-sulfanylquinolin-1-ium-3-sulfonate

Systemtic Name: 4-sulfanylquinolin-1-ium-3-sulfonate Openeye Name: 4-sulfanylquinolin-1-ium-3-sulfonate CAS Name: 4-mercapto-3-quinolin-1-iumsulfonate IUPAC Name: 4-sulfanylquinolin-1-ium-3-sulfonate Traditional Name: 4-mercaptoquinolin-1-ium-3-sulfonate Formula: C9H7NO3S2 MolecularWeight: 241.28678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=[NH+]2)S(=O)(=O)[O-])S

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=[NH+]2)S(=O)(=O)[O-])S

InChI

InChI=1S/C9H7NO3S2/c11-15(12,13)8-5-10-7-4-2-1-3-6(7)9(8)14/h1-5H,(H,10,14)(H,11,12,13)