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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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