1-[6-(4-nonylphenyl)pyridazin-3-yl]oxypropan-2-yl propanoate

Systemtic Name: 1-[6-(4-nonylphenyl)pyridazin-3-yl]oxypropan-2-yl propanoate Openeye Name: [1-methyl-2-[6-(4-nonylphenyl)pyridazin-3-yl]oxy-ethyl] propanoate CAS Name: propanoic acid 1-[[6-(4-nonylphenyl)-3-pyridazinyl]oxy]propan-2-yl ester IUPAC Name: 1-[6-(4-nonylphenyl)pyridazin-3-yl]oxypropan-2-yl propanoate Traditional Name: propionic acid [1-methyl-2-[6-(4-nonylphenyl)pyridazin-3-yl]oxy-ethyl] ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)OCC(C)OC(=O)CC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)OCC(C)OC(=O)CC

InChI

InChI=1S/C25H36N2O3/c1-4-6-7-8-9-10-11-12-21-13-15-22(16-14-21)23-17-18-24(27-26-23)29-19-20(3)30-25(28)5-2/h13-18,20H,4-12,19H2,1-3H3