3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-(4-fluorophenyl)-3,5-dimethyl-4-pyrazolecarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C22H21FN4O3 MolecularWeight: 408.425543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)OCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)OCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H21FN4O3/c1-14-20(15(2)27(25-14)17-10-8-16(23)9-11-17)21(28)30-13-5-12-26-19-7-4-3-6-18(19)24-22(26)29/h3-4,6-11H,5,12-13H2,1-2H3,(H,24,29)