N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropoxy)benzenesulfonamide

Systemtic Name: N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropoxy)benzenesulfonamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-isobutoxy-benzenesulfonamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropoxy)benzenesulfonamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropoxy)benzenesulfonamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-isobutoxy-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2

InChI

InChI=1S/C21H26N2O4S/c1-15(2)14-27-20-6-8-21(9-7-20)28(25,26)22-19-5-4-17-10-11-23(16(3)24)13-18(17)12-19/h4-9,12,15,22H,10-11,13-14H2,1-3H3