3-[5,6-bis(4-methoxyphenyl)pyridazin-3-yl]propanoic acid

Systemtic Name: 3-[5,6-bis(4-methoxyphenyl)pyridazin-3-yl]propanoic acid Openeye Name: 3-[5,6-bis(4-methoxyphenyl)pyridazin-3-yl]propanoic acid CAS Name: 3-[5,6-bis(4-methoxyphenyl)-3-pyridazinyl]propanoic acid IUPAC Name: 3-[5,6-bis(4-methoxyphenyl)pyridazin-3-yl]propanoic acid Traditional Name: 3-[5,6-bis(4-methoxyphenyl)pyridazin-3-yl]propionic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=C(C=C3)OC)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=C(C=C3)OC)CCC(=O)O

InChI

InChI=1S/C21H20N2O4/c1-26-17-8-3-14(4-9-17)19-13-16(7-12-20(24)25)22-23-21(19)15-5-10-18(27-2)11-6-15/h3-6,8-11,13H,7,12H2,1-2H3,(H,24,25)