2-(3,5-dimethoxyphenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name: 2-(3,5-dimethoxyphenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-(3,5-dimethoxyphenyl)-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 2-(3,5-dimethoxyphenyl)-4-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-phthalazinone IUPAC Name: 2-(3,5-dimethoxyphenyl)-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-(3,5-dimethoxyphenyl)-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one Formula: C28H28N4O5 MolecularWeight: 500.54572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC(=CC(=C5)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC(=CC(=C5)OC)OC

InChI

InChI=1S/C28H28N4O5/c1-35-21-10-8-19(9-11-21)30-12-14-31(15-13-30)28(34)26-24-6-4-5-7-25(24)27(33)32(29-26)20-16-22(36-2)18-23(17-20)37-3/h4-11,16-18H,12-15H2,1-3H3