4-chloranyl-N-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzenesulfonamide Openeye Name: 4-chloro-N-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzenesulfonamide CAS Name: 4-chloro-N-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzenesulfonamide Traditional Name: 4-chloro-N-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzenesulfonamide Formula: C19H24ClN2O4S+ MolecularWeight: 411.92286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=CC(=C(C=C2C1CNS(=O)(=O)C3=CC=C(C=C3)Cl)OC)OC

Isomeric SMILES

C[NH+]1CCC2=CC(=C(C=C2[C@@H]1CNS(=O)(=O)C3=CC=C(C=C3)Cl)OC)OC

InChI

InChI=1S/C19H23ClN2O4S/c1-22-9-8-13-10-18(25-2)19(26-3)11-16(13)17(22)12-21-27(23,24)15-6-4-14(20)5-7-15/h4-7,10-11,17,21H,8-9,12H2,1-3H3/p+1/t17-/m0/s1