pyridazin-4-yl 2-chloranyl-5-(2-cyclopropyl-6-methyl-phenoxy)cyclohexane-1-carboxylate

Systemtic Name: pyridazin-4-yl 2-chloranyl-5-(2-cyclopropyl-6-methyl-phenoxy)cyclohexane-1-carboxylate Openeye Name: pyridazin-4-yl 2-chloro-5-(2-cyclopropyl-6-methyl-phenoxy)cyclohexanecarboxylate CAS Name: 2-chloro-5-(2-cyclopropyl-6-methylphenoxy)-1-cyclohexanecarboxylic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 2-chloro-5-(2-cyclopropyl-6-methylphenoxy)cyclohexane-1-carboxylate Traditional Name: 2-chloro-5-(2-cyclopropyl-6-methyl-phenoxy)cyclohexanecarboxylic acid pyridazin-4-yl ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2CCC(C(C2)C(=O)OC3=CN=NC=C3)Cl)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1OC2CCC(C(C2)C(=O)OC3=CN=NC=C3)Cl)C4CC4

InChI

InChI=1S/C21H23ClN2O3/c1-13-3-2-4-17(14-5-6-14)20(13)26-15-7-8-19(22)18(11-15)21(25)27-16-9-10-23-24-12-16/h2-4,9-10,12,14-15,18-19H,5-8,11H2,1H3