1-[1-(3-chloranyl-4,5-dimethoxy-phenyl)-6-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 1-[1-(3-chloranyl-4,5-dimethoxy-phenyl)-6-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 1-[1-(3-chloro-4,5-dimethoxy-phenyl)-6-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[1-(3-chloro-4,5-dimethoxyphenyl)-6-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-[1-(3-chloro-4,5-dimethoxyphenyl)-6-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 1-[1-(3-chloro-4,5-dimethoxy-phenyl)-6-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(N(CC2)C(=O)C)C3=CC(=C(C(=C3)Cl)OC)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(N(CC2)C(=O)C)C3=CC(=C(C(=C3)Cl)OC)OC

InChI

InChI=1S/C21H24ClNO4/c1-5-27-16-6-7-17-14(10-16)8-9-23(13(2)24)20(17)15-11-18(22)21(26-4)19(12-15)25-3/h6-7,10-12,20H,5,8-9H2,1-4H3