N-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-4-ethoxy-benzenesulfonamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-4-ethoxy-benzenesulfonamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-4-ethoxy-benzenesulfonamide CAS Name: N-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-4-ethoxybenzenesulfonamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-4-ethoxybenzenesulfonamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-4-ethoxy-benzenesulfonamide Formula: C24H24N2O4S MolecularWeight: 436.52336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H24N2O4S/c1-2-30-22-10-12-23(13-11-22)31(28,29)25-21-9-5-8-19(16-21)24(27)26-15-14-18-6-3-4-7-20(18)17-26/h3-13,16,25H,2,14-15,17H2,1H3