methyl 5-azanyl-1-[4-[[4-(trifluoromethyloxy)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[4-[[4-(trifluoromethyloxy)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[4-[[4-(trifluoromethoxy)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[oxo-[4-(trifluoromethoxy)anilino]methyl]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[4-[[4-(trifluoromethoxy)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[[4-(trifluoromethoxy)phenyl]carbamoyl]phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C19H15F3N4O4 MolecularWeight: 420.34201

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F)N

InChI

InChI=1S/C19H15F3N4O4/c1-29-18(28)15-10-24-26(16(15)23)13-6-2-11(3-7-13)17(27)25-12-4-8-14(9-5-12)30-19(20,21)22/h2-10H,23H2,1H3,(H,25,27)