N-(4-ethanoylphenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide

Systemtic Name: N-(4-ethanoylphenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide Openeye Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide CAS Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-4-propoxy-3-pyrazolecarboxamide IUPAC Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-4-propoxypyrazole-3-carboxamide Traditional Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CN(N=C1C(=O)NC2=CC=C(C=C2)C(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCCOC1=CN(N=C1C(=O)NC2=CC=C(C=C2)C(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O3/c1-3-12-28-19-13-25(18-10-6-16(22)7-11-18)24-20(19)21(27)23-17-8-4-15(5-9-17)14(2)26/h4-11,13H,3,12H2,1-2H3,(H,23,27)