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

Systemtic Name: [6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3,5-dimethoxybenzoate Openeye Name: [6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic 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-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] ester Formula: C23H21ClN2O5 MolecularWeight: 440.87624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClN2O5/c1-13-5-4-6-18(14-7-8-14)21(13)31-22-19(12-20(24)25-26-22)30-23(27)15-9-16(28-2)11-17(10-15)29-3/h4-6,9-12,14H,7-8H2,1-3H3