3-chloranyl-2-fluoranyl-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-6-(trifluoromethyl)benzamide

Systemtic Name: 3-chloranyl-2-fluoranyl-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-6-(trifluoromethyl)benzamide Openeye Name: N-[1-(2-benzyloxyethyl)pyrazol-4-yl]-3-chloro-2-fluoro-6-(trifluoromethyl)benzamide CAS Name: 3-chloro-2-fluoro-N-[1-(2-phenylmethoxyethyl)-4-pyrazolyl]-6-(trifluoromethyl)benzamide IUPAC Name: 3-chloro-2-fluoro-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-6-(trifluoromethyl)benzamide Traditional Name: N-[1-(2-benzoxyethyl)pyrazol-4-yl]-3-chloro-2-fluoro-6-(trifluoromethyl)benzamide Formula: C20H16ClF4N3O2 MolecularWeight: 441.806553

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCN2C=C(C=N2)NC(=O)C3=C(C=CC(=C3F)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COCCN2C=C(C=N2)NC(=O)C3=C(C=CC(=C3F)Cl)C(F)(F)F

InChI

InChI=1S/C20H16ClF4N3O2/c21-16-7-6-15(20(23,24)25)17(18(16)22)19(29)27-14-10-26-28(11-14)8-9-30-12-13-4-2-1-3-5-13/h1-7,10-11H,8-9,12H2,(H,27,29)