4-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-(3-methoxyphenyl)phthalazin-1-one

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-(3-methoxyphenyl)phthalazin-1-one Openeye Name: 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)phthalazin-1-one CAS Name: 4-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-2-(3-methoxyphenyl)-1-phthalazinone IUPAC Name: 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)phthalazin-1-one Traditional Name: 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)phthalazin-1-one Formula: C26H23FN4O3 MolecularWeight: 458.484223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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