2-(2-chloranyl-4-fluoranyl-phenoxy)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(2-chloranyl-4-fluoranyl-phenoxy)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(2-chloro-4-fluoro-phenoxy)-1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 2-(2-chloro-4-fluorophenoxy)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2-chloro-4-fluorophenoxy)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(2-chloro-4-fluoro-phenoxy)-1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C23H21ClFNO4S MolecularWeight: 461.933543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)COC3=C(C=C(C=C3)F)Cl)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)COC3=C(C=C(C=C3)F)Cl)C4=CC=CS4)OC

InChI

InChI=1S/C23H21ClFNO4S/c1-28-19-10-14-7-8-26(22(27)13-30-18-6-5-15(25)11-17(18)24)23(21-4-3-9-31-21)16(14)12-20(19)29-2/h3-6,9-12,23H,7-8,13H2,1-2H3