5-[4-[(2-hydroxyphenyl)methyl]piperazin-1-yl]-4-[3-(4-methoxyphenyl)propoxy]-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[4-[(2-hydroxyphenyl)methyl]piperazin-1-yl]-4-[3-(4-methoxyphenyl)propoxy]-2-phenyl-pyridazin-3-one Openeye Name: 5-[4-[(2-hydroxyphenyl)methyl]piperazin-1-yl]-4-[3-(4-methoxyphenyl)propoxy]-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[(2-hydroxyphenyl)methyl]-1-piperazinyl]-4-[3-(4-methoxyphenyl)propoxy]-2-phenyl-3-pyridazinone IUPAC Name: 5-[4-[(2-hydroxyphenyl)methyl]piperazin-1-yl]-4-[3-(4-methoxyphenyl)propoxy]-2-phenylpyridazin-3-one Traditional Name: 4-[3-(4-methoxyphenyl)propoxy]-2-phenyl-5-(4-salicylpiperazino)pyridazin-3-one Formula: C31H34N4O4 MolecularWeight: 526.62606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCOC2=C(C=NN(C2=O)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5O

Isomeric SMILES

COC1=CC=C(C=C1)CCCOC2=C(C=NN(C2=O)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5O

InChI

InChI=1S/C31H34N4O4/c1-38-27-15-13-24(14-16-27)8-7-21-39-30-28(22-32-35(31(30)37)26-10-3-2-4-11-26)34-19-17-33(18-20-34)23-25-9-5-6-12-29(25)36/h2-6,9-16,22,36H,7-8,17-21,23H2,1H3