(6-chloranylpyridazin-4-yl) 3-(2-cyclopropyl-6-methyl-phenoxy)-3-methyl-butanoate

Systemtic Name: (6-chloranylpyridazin-4-yl) 3-(2-cyclopropyl-6-methyl-phenoxy)-3-methyl-butanoate Openeye Name: (6-chloropyridazin-4-yl) 3-(2-cyclopropyl-6-methyl-phenoxy)-3-methyl-butanoate CAS Name: 3-(2-cyclopropyl-6-methylphenoxy)-3-methylbutanoic acid (6-chloro-4-pyridazinyl) ester IUPAC Name: (6-chloropyridazin-4-yl) 3-(2-cyclopropyl-6-methylphenoxy)-3-methylbutanoate Traditional Name: 3-(2-cyclopropyl-6-methyl-phenoxy)-3-methyl-butyric acid (6-chloropyridazin-4-yl) ester Formula: C19H21ClN2O3 MolecularWeight: 360.83464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC(C)(C)CC(=O)OC2=CC(=NN=C2)Cl)C3CC3

Isomeric SMILES

CC1=CC=CC(=C1OC(C)(C)CC(=O)OC2=CC(=NN=C2)Cl)C3CC3

InChI

InChI=1S/C19H21ClN2O3/c1-12-5-4-6-15(13-7-8-13)18(12)25-19(2,3)10-17(23)24-14-9-16(20)22-21-11-14/h4-6,9,11,13H,7-8,10H2,1-3H3