ethyl 1-(4-fluorophenyl)-5-[4-(2-oxidanylideneethylamino)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-5-[4-(2-oxidanylideneethylamino)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-5-[4-(2-oxoethylamino)phenyl]pyrazole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-5-[4-(2-oxoethylamino)phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-5-[4-(2-oxoethylamino)phenyl]pyrazole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-5-[4-(2-ketoethylamino)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C20H18FN3O3 MolecularWeight: 367.373623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)NCC=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)NCC=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H18FN3O3/c1-2-27-20(26)18-13-19(14-3-7-16(8-4-14)22-11-12-25)24(23-18)17-9-5-15(21)6-10-17/h3-10,12-13,22H,2,11H2,1H3