ethyl 5-[3-chloranyl-4-(trifluoromethyl)phenyl]-4-methyl-2-(phenylcarbamoyl)-3H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[3-chloranyl-4-(trifluoromethyl)phenyl]-4-methyl-2-(phenylcarbamoyl)-3H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[3-chloro-4-(trifluoromethyl)phenyl]-4-methyl-2-(phenylcarbamoyl)-3H-pyrazole-4-carboxylate CAS Name: 2-[anilino(oxo)methyl]-5-[3-chloro-4-(trifluoromethyl)phenyl]-4-methyl-3H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-chloro-4-(trifluoromethyl)phenyl]-4-methyl-2-(phenylcarbamoyl)-3H-pyrazole-4-carboxylate Traditional Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-4-methyl-1-(phenylcarbamoyl)-2-pyrazoline-4-carboxylic acid ethyl ester Formula: C21H19ClF3N3O3 MolecularWeight: 453.84207

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CN(N=C1C2=CC(=C(C=C2)C(F)(F)F)Cl)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1(CN(N=C1C2=CC(=C(C=C2)C(F)(F)F)Cl)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H19ClF3N3O3/c1-3-31-18(29)20(2)12-28(19(30)26-14-7-5-4-6-8-14)27-17(20)13-9-10-15(16(22)11-13)21(23,24)25/h4-11H,3,12H2,1-2H3,(H,26,30)