N-[3-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]benzenesulfonamide

Systemtic Name: N-[3-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]benzenesulfonamide Openeye Name: N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzenesulfonamide CAS Name: N-[3-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzenesulfonamide Traditional Name: N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzenesulfonamide Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)OCC

InChI

InChI=1S/C26H28N2O5S/c1-3-32-24-16-19-13-14-28(18-21(19)17-25(24)33-4-2)26(29)20-9-8-10-22(15-20)27-34(30,31)23-11-6-5-7-12-23/h5-12,15-17,27H,3-4,13-14,18H2,1-2H3