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

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

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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(=CC=C5)Cl

Isomeric SMILES

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

InChI

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