2-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(2,3-dimethyl-1-imidazol-3-iumyl)sulfonyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C14H18N3O2S+ MolecularWeight: 292.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1S(=O)(=O)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=[N+](C=CN1S(=O)(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C14H18N3O2S/c1-12-15(2)9-10-17(12)20(18,19)16-8-7-13-5-3-4-6-14(13)11-16/h3-6,9-10H,7-8,11H2,1-2H3/q+1