ethyl 1-[3-[[4-(4-fluorophenyl)-4-oxidanylidene-butanoyl]amino]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[[4-(4-fluorophenyl)-4-oxidanylidene-butanoyl]amino]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[[4-(4-fluorophenyl)-4-oxo-butanoyl]amino]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[3-[[4-(4-fluorophenyl)-1,4-dioxobutyl]amino]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[3-[[4-(4-fluorophenyl)-4-keto-butanoyl]amino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C23H22FN3O4 MolecularWeight: 423.436883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CCC(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CCC(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C23H22FN3O4/c1-3-31-23(30)20-14-25-27(15(20)2)19-6-4-5-18(13-19)26-22(29)12-11-21(28)16-7-9-17(24)10-8-16/h4-10,13-14H,3,11-12H2,1-2H3,(H,26,29)