5-chloranyl-2-(2-cyclopropyl-6-methyl-phenoxy)-4-pyridazin-4-yloxycarbonyl-benzoate

Systemtic Name: 5-chloranyl-2-(2-cyclopropyl-6-methyl-phenoxy)-4-pyridazin-4-yloxycarbonyl-benzoate Openeye Name: 5-chloro-2-(2-cyclopropyl-6-methyl-phenoxy)-4-pyridazin-4-yloxycarbonyl-benzoate CAS Name: 5-chloro-2-(2-cyclopropyl-6-methylphenoxy)-4-[oxo(4-pyridazinyloxy)methyl]benzoate IUPAC Name: 5-chloro-2-(2-cyclopropyl-6-methylphenoxy)-4-pyridazin-4-yloxycarbonylbenzoate Traditional Name: 5-chloro-2-(2-cyclopropyl-6-methyl-phenoxy)-4-pyridazin-4-yloxycarbonyl-benzoate Formula: C22H16ClN2O5- MolecularWeight: 423.82584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClN2O5/c1-12-3-2-4-15(13-5-6-13)20(12)30-19-10-16(18(23)9-17(19)21(26)27)22(28)29-14-7-8-24-25-11-14/h2-4,7-11,13H,5-6H2,1H3,(H,26,27)/p-1