3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-benzenesulfonamide CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethylbenzenesulfonamide Traditional Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-benzenesulfonamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C22H28N2O5S/c1-5-24(6-2)30(26,27)19-9-7-8-17(12-19)22(25)23-11-10-16-13-20(28-3)21(29-4)14-18(16)15-23/h7-9,12-14H,5-6,10-11,15H2,1-4H3