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

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(4-chloro-3-methylphenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(4-chloro-3-methylphenoxy)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(4-chloro-3-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=CC(=C(C=C3)Cl)C)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)COC3=CC(=C(C=C3)Cl)C)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)14-28-18-6-7-19(23)15(3)10-18/h6-7,10-12H,4-5,8-9,13-14H2,1-3H3