1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2,2-diphenyl-ethanone

Systemtic Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2,2-diphenyl-ethanone Openeye Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2,2-diphenyl-ethanone CAS Name: 1-[4-[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-2,2-diphenylethanone IUPAC Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2,2-diphenylethanone Traditional Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazino]-2,2-diphenyl-ethanone Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H30N4O3/c1-36-24-13-15-27(37-2)25(21-24)26-14-16-28(32-31-26)33-17-19-34(20-18-33)30(35)29(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-16,21,29H,17-20H2,1-2H3