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

Systemtic Name: 3-[(3,4-dimethoxyphenyl)amino]-2H-isoquinolin-1-one Openeye Name: 3-(3,4-dimethoxyanilino)-2H-isoquinolin-1-one CAS Name: 3-(3,4-dimethoxyanilino)-2H-isoquinolin-1-one IUPAC Name: 3-(3,4-dimethoxyanilino)-2H-isoquinolin-1-one Traditional Name: 3-(3,4-dimethoxyanilino)isocarbostyril Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=CC3=CC=CC=C3C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=CC3=CC=CC=C3C(=O)N2)OC

InChI

InChI=1S/C17H16N2O3/c1-21-14-8-7-12(10-15(14)22-2)18-16-9-11-5-3-4-6-13(11)17(20)19-16/h3-10H,1-2H3,(H2,18,19,20)