ethyl 1-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-[4-[(2-methoxyanilino)-oxomethyl]phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C21H18F3N3O4 MolecularWeight: 433.38053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3OC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3OC)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O4/c1-3-31-20(29)15-12-25-27(18(15)21(22,23)24)14-10-8-13(9-11-14)19(28)26-16-6-4-5-7-17(16)30-2/h4-12H,3H2,1-2H3,(H,26,28)