2-[2,4-bis(fluoranyl)phenyl]sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(2,4-difluorophenyl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(2,4-difluorophenyl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(2,4-difluorophenyl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(2,4-difluorophenyl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Formula: C20H23F2NO4S MolecularWeight: 411.462726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=C(C=C(C=C3)F)F)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=C(C=C(C=C3)F)F)C)OCC

InChI

InChI=1S/C20H23F2NO4S/c1-4-26-18-10-14-8-9-23(13(3)16(14)12-19(18)27-5-2)28(24,25)20-7-6-15(21)11-17(20)22/h6-7,10-13H,4-5,8-9H2,1-3H3