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

Systemtic Name: 2-(4-chloranyl-3-ethyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(4-chloro-3-ethyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(4-chloro-3-ethylphenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(4-chloro-3-ethylphenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(4-chloro-3-ethyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)Cl

InChI

InChI=1S/C21H24ClNO4/c1-4-14-9-17(5-6-18(14)22)27-13-21(24)23-8-7-15-10-19(25-2)20(26-3)11-16(15)12-23/h5-6,9-11H,4,7-8,12-13H2,1-3H3