1-(2-chloranyl-5-methyl-phenoxy)-4-[3-(trifluoromethyl)phenyl]phthalazine

Systemtic Name: 1-(2-chloranyl-5-methyl-phenoxy)-4-[3-(trifluoromethyl)phenyl]phthalazine Openeye Name: 1-(2-chloro-5-methyl-phenoxy)-4-[3-(trifluoromethyl)phenyl]phthalazine CAS Name: 1-(2-chloro-5-methylphenoxy)-4-[3-(trifluoromethyl)phenyl]phthalazine IUPAC Name: 1-(2-chloro-5-methylphenoxy)-4-[3-(trifluoromethyl)phenyl]phthalazine Traditional Name: 1-(2-chloro-5-methyl-phenoxy)-4-[3-(trifluoromethyl)phenyl]phthalazine Formula: C22H14ClF3N2O MolecularWeight: 414.80757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC2=NN=C(C3=CC=CC=C32)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC2=NN=C(C3=CC=CC=C32)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H14ClF3N2O/c1-13-9-10-18(23)19(11-13)29-21-17-8-3-2-7-16(17)20(27-28-21)14-5-4-6-15(12-14)22(24,25)26/h2-12H,1H3