[6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3-methylbenzoate

Systemtic Name: [6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3-methylbenzoate Openeye Name: [6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [6-chloro-3-(2-cyclopropyl-6-methylphenoxy)-4-pyridazinyl] ester IUPAC Name: [6-chloro-3-(2-cyclopropyl-6-methylphenoxy)pyridazin-4-yl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pyridazin-4-yl] ester Formula: C22H19ClN2O3 MolecularWeight: 394.85086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=CC(=NN=C2OC3=C(C=CC=C3C)C4CC4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=CC(=NN=C2OC3=C(C=CC=C3C)C4CC4)Cl

InChI

InChI=1S/C22H19ClN2O3/c1-13-5-3-7-16(11-13)22(26)27-18-12-19(23)24-25-21(18)28-20-14(2)6-4-8-17(20)15-9-10-15/h3-8,11-12,15H,9-10H2,1-2H3