4-[2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-piperidyl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[4-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-2-[4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]piperidino]ethyl]-2H-phthalazin-1-one Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C27H31N5O4/c1-36-24-9-5-4-8-23(24)30-14-16-32(17-15-30)27(35)19-10-12-31(13-11-19)25(33)18-22-20-6-2-3-7-21(20)26(34)29-28-22/h2-9,19H,10-18H2,1H3,(H,29,34)