4-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-(4-methoxyphenyl)phthalazin-1-one

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-(4-methoxyphenyl)phthalazin-1-one Openeye Name: 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(4-methoxyphenyl)phthalazin-1-one CAS Name: 4-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-2-(4-methoxyphenyl)-1-phthalazinone IUPAC Name: 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(4-methoxyphenyl)phthalazin-1-one Traditional Name: 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(4-methoxyphenyl)phthalazin-1-one Formula: C26H23FN4O3 MolecularWeight: 458.484223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H23FN4O3/c1-34-21-12-10-20(11-13-21)31-25(32)23-5-3-2-4-22(23)24(28-31)26(33)30-16-14-29(15-17-30)19-8-6-18(27)7-9-19/h2-13H,14-17H2,1H3