isoquinolin-2-ium; methyl sulfate

Systemtic Name: isoquinolin-2-ium; methyl sulfate Openeye Name: isoquinolin-2-ium; methyl sulfate CAS Name: isoquinolin-2-ium; methyl sulfate IUPAC Name: isoquinolin-2-ium; methyl sulfate Traditional Name: isoquinolin-2-ium; methyl sulfate Formula: C10H11NO4S MolecularWeight: 241.26364

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)[O-].C1=CC=C2C=[NH+]C=CC2=C1

Isomeric SMILES

COS(=O)(=O)[O-].C1=CC=C2C=[NH+]C=CC2=C1

InChI

InChI=1S/C9H7N.CH4O4S/c1-2-4-9-7-10-6-5-8(9)3-1;1-5-6(2,3)4/h1-7H;1H3,(H,2,3,4)