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

Systemtic Name: 3-ethanoyl-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Openeye Name: 3-acetyl-N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide CAS Name: 3-acetyl-N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide IUPAC Name: 3-acetyl-N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Traditional Name: 3-acetyl-N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)benzenesulfonamide Formula: C23H22N2O5S2 MolecularWeight: 470.56118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C23H22N2O5S2/c1-17(26)19-6-5-9-23(15-19)31(27,28)24-21-11-10-18-12-13-25(16-20(18)14-21)32(29,30)22-7-3-2-4-8-22/h2-11,14-15,24H,12-13,16H2,1H3