N-tert-butyl-2-chloranyl-5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide

Systemtic Name: N-tert-butyl-2-chloranyl-5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide Openeye Name: N-tert-butyl-2-chloro-5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide CAS Name: N-tert-butyl-2-chloro-5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N-tert-butyl-2-chloro-5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Traditional Name: N-tert-butyl-2-chloro-5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)Cl

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)Cl

InChI

InChI=1S/C22H27ClN2O5S/c1-22(2,3)24-31(27,28)20-12-15(6-7-17(20)23)21(26)25-9-8-14-10-18(29-4)19(30-5)11-16(14)13-25/h6-7,10-12,24H,8-9,13H2,1-5H3