4-[6,8-bis(chloranyl)-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-4-yl]benzenesulfonamide

Systemtic Name: 4-[6,8-bis(chloranyl)-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-4-yl]benzenesulfonamide Openeye Name: 4-(6,8-dichloro-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-4-yl)benzenesulfonamide CAS Name: 4-(6,8-dichloro-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-4-yl)benzenesulfonamide IUPAC Name: 4-(6,8-dichloro-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-4-yl)benzenesulfonamide Traditional Name: 4-(6,8-dichloro-2,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-4-yl)benzenesulfonamide Formula: C17H19Cl2N2O2S+ MolecularWeight: 386.31596

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC(C2=CC(=CC(=C2C1)Cl)Cl)C3=CC=C(C=C3)S(=O)(=O)N)C

Isomeric SMILES

C[N+]1(CC(C2=CC(=CC(=C2C1)Cl)Cl)C3=CC=C(C=C3)S(=O)(=O)N)C

InChI

InChI=1S/C17H19Cl2N2O2S/c1-21(2)9-15(11-3-5-13(6-4-11)24(20,22)23)14-7-12(18)8-17(19)16(14)10-21/h3-8,15H,9-10H2,1-2H3,(H2,20,22,23)/q+1