2-[2-oxidanylidene-2-(4-oxidanyl-4-pyridin-2-yl-piperidin-1-yl)ethyl]phthalazin-1-one

Systemtic Name: 2-[2-oxidanylidene-2-(4-oxidanyl-4-pyridin-2-yl-piperidin-1-yl)ethyl]phthalazin-1-one Openeye Name: 2-[2-[4-hydroxy-4-(2-pyridyl)-1-piperidyl]-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[2-[4-hydroxy-4-(2-pyridinyl)-1-piperidinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-[2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-[4-hydroxy-4-(2-pyridyl)piperidino]-2-keto-ethyl]phthalazin-1-one Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=N2)O)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=N2)O)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C20H20N4O3/c25-18(14-24-19(26)16-6-2-1-5-15(16)13-22-24)23-11-8-20(27,9-12-23)17-7-3-4-10-21-17/h1-7,10,13,27H,8-9,11-12,14H2