2-(2-chloranyl-5-methyl-phenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(2-chloranyl-5-methyl-phenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(2-chloro-5-methyl-phenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(2-chloro-5-methylphenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2-chloro-5-methylphenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(2-chloro-5-methyl-phenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C22H26ClNO4 MolecularWeight: 403.89914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)COC3=C(C=CC(=C3)C)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)COC3=C(C=CC(=C3)C)Cl)OCC

InChI

InChI=1S/C22H26ClNO4/c1-4-26-20-11-16-8-9-24(13-17(16)12-21(20)27-5-2)22(25)14-28-19-10-15(3)6-7-18(19)23/h6-7,10-12H,4-5,8-9,13-14H2,1-3H3