(Z)-4-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid

Systemtic Name: (Z)-4-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid Openeye Name: (Z)-4-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-oxo-3-(2-quinolyl)but-3-enoic acid CAS Name: (Z)-4-[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-2-oxo-3-(2-quinolinyl)-3-butenoic acid IUPAC Name: (Z)-4-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]-2-oxo-3-quinolin-2-ylbut-3-enoic acid Traditional Name: (Z)-4-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-keto-3-(2-quinolyl)but-3-enoic acid Formula: C23H15ClFN3O3 MolecularWeight: 435.834903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C2=NC3=CC=CC=C3C=C2)C(=O)C(=O)O)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1/C=C(/C2=NC3=CC=CC=C3C=C2)\C(=O)C(=O)O)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H15ClFN3O3/c1-13-17(22(24)28(27-13)16-9-7-15(25)8-10-16)12-18(21(29)23(30)31)20-11-6-14-4-2-3-5-19(14)26-20/h2-12H,1H3,(H,30,31)/b18-12-