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

Systemtic Name: pyridazin-4-yl 6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)-2-phenoxy-benzoate Openeye Name: pyridazin-4-yl 6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)-2-phenoxy-benzoate CAS Name: 6-chloro-3-(2-cyclopropyl-6-methylphenoxy)-2-phenoxybenzoic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 6-chloro-3-(2-cyclopropyl-6-methylphenoxy)-2-phenoxybenzoate Traditional Name: 6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)-2-phenoxy-benzoic acid pyridazin-4-yl ester Formula: C27H21ClN2O4 MolecularWeight: 472.91964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2=C(C(=C(C=C2)Cl)C(=O)OC3=CN=NC=C3)OC4=CC=CC=C4)C5CC5

Isomeric SMILES

CC1=CC=CC(=C1OC2=C(C(=C(C=C2)Cl)C(=O)OC3=CN=NC=C3)OC4=CC=CC=C4)C5CC5

InChI

InChI=1S/C27H21ClN2O4/c1-17-6-5-9-21(18-10-11-18)25(17)34-23-13-12-22(28)24(26(23)32-19-7-3-2-4-8-19)27(31)33-20-14-15-29-30-16-20/h2-9,12-16,18H,10-11H2,1H3