8-methylsulfonylquinoline-5-sulfonic acid

Systemtic Name: 8-methylsulfonylquinoline-5-sulfonic acid Openeye Name: 8-methylsulfonylquinoline-5-sulfonic acid CAS Name: 8-methylsulfonyl-5-quinolinesulfonic acid IUPAC Name: 8-methylsulfonylquinoline-5-sulfonic acid Traditional Name: 8-mesylquinoline-5-sulfonic acid Formula: C10H9NO5S2 MolecularWeight: 287.31216

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=N2

Isomeric SMILES

CS(=O)(=O)C1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=N2

InChI

InChI=1S/C10H9NO5S2/c1-17(12,13)9-5-4-8(18(14,15)16)7-3-2-6-11-10(7)9/h2-6H,1H3,(H,14,15,16)