4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N,N-dimethyl-benzenesulfonamide CAS Name: 4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N,N-dimethylbenzenesulfonamide Traditional Name: 4-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N,N-dimethyl-benzenesulfonamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC=C(C=C3)S(=O)(=O)N(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=CC=C(C=C3)S(=O)(=O)N(C)C)OCC

InChI

InChI=1S/C21H28N2O4S/c1-5-26-19-13-16-11-12-22-21(18(16)14-20(19)27-6-2)15-7-9-17(10-8-15)28(24,25)23(3)4/h7-10,13-14,21-22H,5-6,11-12H2,1-4H3