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

Systemtic Name: 2-[1-oxidanylidene-1-(4-oxidanyl-4-pyridin-2-yl-piperidin-1-yl)propan-2-yl]phthalazin-1-one Openeye Name: 2-[2-[4-hydroxy-4-(2-pyridyl)-1-piperidyl]-1-methyl-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[1-[4-hydroxy-4-(2-pyridinyl)-1-piperidinyl]-1-oxopropan-2-yl]-1-phthalazinone IUPAC Name: 2-[1-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)-1-oxopropan-2-yl]phthalazin-1-one Traditional Name: 2-[2-[4-hydroxy-4-(2-pyridyl)piperidino]-2-keto-1-methyl-ethyl]phthalazin-1-one Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)(C2=CC=CC=N2)O)N3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

CC(C(=O)N1CCC(CC1)(C2=CC=CC=N2)O)N3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C21H22N4O3/c1-15(25-20(27)17-7-3-2-6-16(17)14-23-25)19(26)24-12-9-21(28,10-13-24)18-8-4-5-11-22-18/h2-8,11,14-15,28H,9-10,12-13H2,1H3