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

Systemtic Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-7-methyl-2H-isoquinolin-1-one Openeye Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-7-methyl-2H-isoquinolin-1-one CAS Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-7-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-7-methyl-2H-isoquinolin-1-one Traditional Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-7-methyl-isocarbostyril Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(NC2=O)C3=CC(=C(C=C3COCOC)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(NC2=O)C3=CC(=C(C=C3COCOC)OC)OC

InChI

InChI=1S/C21H23NO5/c1-13-5-6-14-8-18(22-21(23)17(14)7-13)16-10-20(26-4)19(25-3)9-15(16)11-27-12-24-2/h5-10H,11-12H2,1-4H3,(H,22,23)