N-tert-butyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-methoxy-benzenesulfonamide

Systemtic Name: N-tert-butyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-methoxy-benzenesulfonamide Openeye Name: N-tert-butyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methoxy-benzenesulfonamide CAS Name: N-tert-butyl-5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-methoxybenzenesulfonamide IUPAC Name: N-tert-butyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methoxybenzenesulfonamide Traditional Name: N-tert-butyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methoxy-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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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=CC=C3C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-21(2,3)22-28(25,26)19-13-16(9-10-18(19)27-4)20(24)23-12-11-15-7-5-6-8-17(15)14-23/h5-10,13,22H,11-12,14H2,1-4H3