[6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3,5-bis(chloranyl)benzoate

Systemtic Name: [6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3,5-bis(chloranyl)benzoate Openeye Name: [6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3,5-dichlorobenzoate CAS Name: 3,5-dichlorobenzoic acid [6-chloro-3-(2-cyclopropyl-6-methylphenoxy)-4-pyridazinyl] ester IUPAC Name: [6-chloro-3-(2-cyclopropyl-6-methylphenoxy)pyridazin-4-yl] 3,5-dichlorobenzoate Traditional Name: 3,5-dichlorobenzoic acid [6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] ester Formula: C21H15Cl3N2O3 MolecularWeight: 449.7144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2=NN=C(C=C2OC(=O)C3=CC(=CC(=C3)Cl)Cl)Cl)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1OC2=NN=C(C=C2OC(=O)C3=CC(=CC(=C3)Cl)Cl)Cl)C4CC4

InChI

InChI=1S/C21H15Cl3N2O3/c1-11-3-2-4-16(12-5-6-12)19(11)29-20-17(10-18(24)25-26-20)28-21(27)13-7-14(22)9-15(23)8-13/h2-4,7-10,12H,5-6H2,1H3