4-[(3,4-dimethoxyphenyl)methyl]-2H-isoquinolin-1-one

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]-2H-isoquinolin-1-one Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]-2H-isoquinolin-1-one CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]-2H-isoquinolin-1-one IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]-2H-isoquinolin-1-one Traditional Name: 4-veratrylisocarbostyril Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=CNC(=O)C3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=CNC(=O)C3=CC=CC=C32)OC

InChI

InChI=1S/C18H17NO3/c1-21-16-8-7-12(10-17(16)22-2)9-13-11-19-18(20)15-6-4-3-5-14(13)15/h3-8,10-11H,9H2,1-2H3,(H,19,20)