2,5-dimethyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[(2R)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzenesulfonamide Formula: C20H27N2O2S+ MolecularWeight: 359.50558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O2S/c1-15-8-9-16(2)20(12-15)25(23,24)21-13-17(3)22-11-10-18-6-4-5-7-19(18)14-22/h4-9,12,17,21H,10-11,13-14H2,1-3H3/p+1/t17-/m1/s1