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

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2-(3-methoxyphenyl)phthalazin-1-one Openeye Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)phthalazin-1-one CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-2-(3-methoxyphenyl)-1-phthalazinone IUPAC Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)phthalazin-1-one Traditional Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-(3-methoxyphenyl)phthalazin-1-one Formula: C26H23ClN4O3 MolecularWeight: 474.93882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN4O3/c1-34-21-9-5-8-20(17-21)31-25(32)23-11-3-2-10-22(23)24(28-31)26(33)30-14-12-29(13-15-30)19-7-4-6-18(27)16-19/h2-11,16-17H,12-15H2,1H3