4-[2-[2-[(6-methylpyridin-3-yl)oxymethyl]morpholin-4-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[2-[(6-methylpyridin-3-yl)oxymethyl]morpholin-4-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[2-[(6-methyl-3-pyridyl)oxymethyl]morpholin-4-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[2-[(6-methyl-3-pyridinyl)oxymethyl]-4-morpholinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[2-[(6-methylpyridin-3-yl)oxymethyl]morpholin-4-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-2-[2-[(6-methyl-3-pyridyl)oxymethyl]morpholino]ethyl]-2H-phthalazin-1-one Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)OCC2CN(CCO2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=NC=C(C=C1)OCC2CN(CCO2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H22N4O4/c1-14-6-7-15(11-22-14)29-13-16-12-25(8-9-28-16)20(26)10-19-17-4-2-3-5-18(17)21(27)24-23-19/h2-7,11,16H,8-10,12-13H2,1H3,(H,24,27)