pyridazin-4-yl 4-tert-butyl-2-chloranyl-5-(2-cyclopropyl-6-methyl-phenoxy)benzoate

Systemtic Name: pyridazin-4-yl 4-tert-butyl-2-chloranyl-5-(2-cyclopropyl-6-methyl-phenoxy)benzoate Openeye Name: pyridazin-4-yl 4-tert-butyl-2-chloro-5-(2-cyclopropyl-6-methyl-phenoxy)benzoate CAS Name: 4-tert-butyl-2-chloro-5-(2-cyclopropyl-6-methylphenoxy)benzoic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 4-tert-butyl-2-chloro-5-(2-cyclopropyl-6-methylphenoxy)benzoate Traditional Name: 4-tert-butyl-2-chloro-5-(2-cyclopropyl-6-methyl-phenoxy)benzoic acid pyridazin-4-yl ester Formula: C25H25ClN2O3 MolecularWeight: 436.9306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25ClN2O3/c1-15-6-5-7-18(16-8-9-16)23(15)31-22-12-19(21(26)13-20(22)25(2,3)4)24(29)30-17-10-11-27-28-14-17/h5-7,10-14,16H,8-9H2,1-4H3