5-[3-[(4-fluorophenyl)amino]-3-oxidanylidene-propyl]-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[3-[(4-fluorophenyl)amino]-3-oxidanylidene-propyl]-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[3-(4-fluoroanilino)-3-oxo-propyl]-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-[3-(4-fluoroanilino)-3-oxopropyl]-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[3-(4-fluoroanilino)-3-oxopropyl]-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[3-(4-fluoroanilino)-3-keto-propyl]-1-phenyl-pyrazole-4-carboxylic acid Formula: C19H16FN3O3 MolecularWeight: 353.347043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)CCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)CCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FN3O3/c20-13-6-8-14(9-7-13)22-18(24)11-10-17-16(19(25)26)12-21-23(17)15-4-2-1-3-5-15/h1-9,12H,10-11H2,(H,22,24)(H,25,26)