isoquinolin-2-ium-5-sulfonyl chloride chloride

Systemtic Name: isoquinolin-2-ium-5-sulfonyl chloride chloride Openeye Name: isoquinolin-2-ium-5-sulfonyl chloride chloride CAS Name: 5-isoquinolin-2-iumsulfonyl chloride chloride IUPAC Name: isoquinolin-2-ium-5-sulfonyl chloride chloride Traditional Name: isoquinolin-2-ium-5-sulfonyl chloride chloride Formula: C9H7Cl2NO2S MolecularWeight: 264.12838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C[NH+]=C2)C(=C1)S(=O)(=O)Cl.[Cl-]

Isomeric SMILES

C1=CC2=C(C=C[NH+]=C2)C(=C1)S(=O)(=O)Cl.[Cl-]

InChI

InChI=1S/C9H6ClNO2S.ClH/c10-14(12,13)9-3-1-2-7-6-11-5-4-8(7)9;/h1-6H;1H