3-[(4-morpholin-4-ylphenyl)carbamoyl]-1-[2-(trifluoromethyl)phenyl]pyrazol-4-olate

Systemtic Name: 3-[(4-morpholin-4-ylphenyl)carbamoyl]-1-[2-(trifluoromethyl)phenyl]pyrazol-4-olate Openeye Name: 3-[(4-morpholinophenyl)carbamoyl]-1-[2-(trifluoromethyl)phenyl]pyrazol-4-olate CAS Name: 3-[[4-(4-morpholinyl)anilino]-oxomethyl]-1-[2-(trifluoromethyl)phenyl]-4-pyrazololate IUPAC Name: 3-[(4-morpholin-4-ylphenyl)carbamoyl]-1-[2-(trifluoromethyl)phenyl]pyrazol-4-olate Traditional Name: 3-[(4-morpholinophenyl)carbamoyl]-1-[2-(trifluoromethyl)phenyl]pyrazol-4-olate Formula: C21H18F3N4O3- MolecularWeight: 431.38783

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=NN(C=C3[O-])C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=NN(C=C3[O-])C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H19F3N4O3/c22-21(23,24)16-3-1-2-4-17(16)28-13-18(29)19(26-28)20(30)25-14-5-7-15(8-6-14)27-9-11-31-12-10-27/h1-8,13,29H,9-12H2,(H,25,30)/p-1