2-methyl-3,4-dihydroisoquinolin-2-ium; methyl sulfate

Systemtic Name: 2-methyl-3,4-dihydroisoquinolin-2-ium; methyl sulfate Openeye Name: 2-methyl-3,4-dihydroisoquinolin-2-ium; methyl sulfate CAS Name: 2-methyl-3,4-dihydroisoquinolin-2-ium; methyl sulfate IUPAC Name: 2-methyl-3,4-dihydroisoquinolin-2-ium; methyl sulfate Traditional Name: 2-methyl-3,4-dihydroisoquinolin-2-ium; methyl sulfate Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC=CC=C2CC1.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC2=CC=CC=C2CC1.COS(=O)(=O)[O-]

InChI

InChI=1S/C10H12N.CH4O4S/c1-11-7-6-9-4-2-3-5-10(9)8-11;1-5-6(2,3)4/h2-5,8H,6-7H2,1H3;1H3,(H,2,3,4)/q+1;/p-1