3-(4-methoxyphenyl)-7-morpholin-4-yl-2H-isoquinolin-1-one

Systemtic Name: 3-(4-methoxyphenyl)-7-morpholin-4-yl-2H-isoquinolin-1-one Openeye Name: 3-(4-methoxyphenyl)-7-morpholino-2H-isoquinolin-1-one CAS Name: 3-(4-methoxyphenyl)-7-(4-morpholinyl)-2H-isoquinolin-1-one IUPAC Name: 3-(4-methoxyphenyl)-7-morpholin-4-yl-2H-isoquinolin-1-one Traditional Name: 3-(4-methoxyphenyl)-7-morpholino-isocarbostyril Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2

InChI

InChI=1S/C20H20N2O3/c1-24-17-6-3-14(4-7-17)19-12-15-2-5-16(13-18(15)20(23)21-19)22-8-10-25-11-9-22/h2-7,12-13H,8-11H2,1H3,(H,21,23)