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

Systemtic Name: pyridazin-4-yl 2-chloranyl-5-(2-cyclopropyl-6-methyl-phenoxy)-3,6-dimethyl-benzoate Openeye Name: pyridazin-4-yl 2-chloro-5-(2-cyclopropyl-6-methyl-phenoxy)-3,6-dimethyl-benzoate CAS Name: 2-chloro-5-(2-cyclopropyl-6-methylphenoxy)-3,6-dimethylbenzoic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 2-chloro-5-(2-cyclopropyl-6-methylphenoxy)-3,6-dimethylbenzoate Traditional Name: 2-chloro-5-(2-cyclopropyl-6-methyl-phenoxy)-3,6-dimethyl-benzoic acid pyridazin-4-yl ester Formula: C23H21ClN2O3 MolecularWeight: 408.87744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClN2O3/c1-13-5-4-6-18(16-7-8-16)22(13)29-19-11-14(2)21(24)20(15(19)3)23(27)28-17-9-10-25-26-12-17/h4-6,9-12,16H,7-8H2,1-3H3