3,4-dimethyl-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide Openeye Name: 3,4-dimethyl-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide CAS Name: 3,4-dimethyl-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide IUPAC Name: 3,4-dimethyl-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide Traditional Name: 3,4-dimethyl-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide Formula: C21H29N2O2S+ MolecularWeight: 373.53216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(C)(C)[NH+]2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(C)(C)[NH+]2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C21H28N2O2S/c1-16-9-10-20(13-17(16)2)26(24,25)22-15-21(3,4)23-12-11-18-7-5-6-8-19(18)14-23/h5-10,13,22H,11-12,14-15H2,1-4H3/p+1