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

Systemtic Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-2H-isoquinolin-1-one Openeye Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-2H-isoquinolin-1-one CAS Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-2H-isoquinolin-1-one IUPAC Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]-2H-isoquinolin-1-one Traditional Name: 3-[4,5-dimethoxy-2-(methoxymethoxymethyl)phenyl]isocarbostyril Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

COCOCC1=CC(=C(C=C1C2=CC3=CC=CC=C3C(=O)N2)OC)OC

Isomeric SMILES

COCOCC1=CC(=C(C=C1C2=CC3=CC=CC=C3C(=O)N2)OC)OC

InChI

InChI=1S/C20H21NO5/c1-23-12-26-11-14-9-18(24-2)19(25-3)10-16(14)17-8-13-6-4-5-7-15(13)20(22)21-17/h4-10H,11-12H2,1-3H3,(H,21,22)