pyridazin-4-yl 5,6,6-tris(chloranyl)-3-(2-cyclopropyl-6-methyl-phenoxy)pyridine-3-carboxylate

Systemtic Name: pyridazin-4-yl 5,6,6-tris(chloranyl)-3-(2-cyclopropyl-6-methyl-phenoxy)pyridine-3-carboxylate Openeye Name: pyridazin-4-yl 5,6,6-trichloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridine-3-carboxylate CAS Name: 5,6,6-trichloro-3-(2-cyclopropyl-6-methylphenoxy)-3-pyridinecarboxylic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 5,6,6-trichloro-3-(2-cyclopropyl-6-methylphenoxy)pyridine-3-carboxylate Traditional Name: 5,6,6-trichloro-3-(2-cyclopropyl-6-methyl-phenoxy)nicotinic acid pyridazin-4-yl ester Formula: C20H16Cl3N3O3 MolecularWeight: 452.71834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2(C=C(C(N=C2)(Cl)Cl)Cl)C(=O)OC3=CN=NC=C3)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1OC2(C=C(C(N=C2)(Cl)Cl)Cl)C(=O)OC3=CN=NC=C3)C4CC4

InChI

InChI=1S/C20H16Cl3N3O3/c1-12-3-2-4-15(13-5-6-13)17(12)29-19(9-16(21)20(22,23)24-11-19)18(27)28-14-7-8-25-26-10-14/h2-4,7-11,13H,5-6H2,1H3