(3-phenoxyphenyl)methyl 2-[2-chloranyl-4-(trifluoromethyl)phenyl]-3-methyl-butanimidate

Systemtic Name: (3-phenoxyphenyl)methyl 2-[2-chloranyl-4-(trifluoromethyl)phenyl]-3-methyl-butanimidate Openeye Name: (3-phenoxyphenyl)methyl 2-[2-chloro-4-(trifluoromethyl)phenyl]-3-methyl-butanimidate CAS Name: 2-[2-chloro-4-(trifluoromethyl)phenyl]-3-methylbutanimidic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 2-[2-chloro-4-(trifluoromethyl)phenyl]-3-methylbutanimidate Traditional Name: 2-[2-chloro-4-(trifluoromethyl)phenyl]-3-methyl-butyrimidic acid (3-phenoxybenzyl) ester Formula: C25H23ClF3NO2 MolecularWeight: 461.90383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C=C(C=C1)C(F)(F)F)Cl)C(=N)OCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C1=C(C=C(C=C1)C(F)(F)F)Cl)C(=N)OCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H23ClF3NO2/c1-16(2)23(21-12-11-18(14-22(21)26)25(27,28)29)24(30)31-15-17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,23,30H,15H2,1-2H3