3-[2-(2-hydroxyethyl)-4,5-dimethoxy-phenyl]-7,8-dimethoxy-2-methyl-isoquinolin-1-one

Systemtic Name: 3-[2-(2-hydroxyethyl)-4,5-dimethoxy-phenyl]-7,8-dimethoxy-2-methyl-isoquinolin-1-one Openeye Name: 3-[2-(2-hydroxyethyl)-4,5-dimethoxy-phenyl]-7,8-dimethoxy-2-methyl-isoquinolin-1-one CAS Name: 3-[2-(2-hydroxyethyl)-4,5-dimethoxyphenyl]-7,8-dimethoxy-2-methyl-1-isoquinolinone IUPAC Name: 3-[2-(2-hydroxyethyl)-4,5-dimethoxyphenyl]-7,8-dimethoxy-2-methylisoquinolin-1-one Traditional Name: 3-[2-(2-hydroxyethyl)-4,5-dimethoxy-phenyl]-7,8-dimethoxy-2-methyl-isocarbostyril Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C1=O)C(=C(C=C2)OC)OC)C3=CC(=C(C=C3CCO)OC)OC

Isomeric SMILES

CN1C(=CC2=C(C1=O)C(=C(C=C2)OC)OC)C3=CC(=C(C=C3CCO)OC)OC

InChI

InChI=1S/C22H25NO6/c1-23-16(15-12-19(28-4)18(27-3)11-13(15)8-9-24)10-14-6-7-17(26-2)21(29-5)20(14)22(23)25/h6-7,10-12,24H,8-9H2,1-5H3