(E)-3-[5-(4-fluorophenyl)-3-propan-2-yl-1-pyridin-2-yl-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-(4-fluorophenyl)-3-propan-2-yl-1-pyridin-2-yl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(4-fluorophenyl)-3-isopropyl-1-(2-pyridyl)pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[5-(4-fluorophenyl)-3-propan-2-yl-1-(2-pyridinyl)-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[5-(4-fluorophenyl)-3-propan-2-yl-1-pyridin-2-ylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(4-fluorophenyl)-3-isopropyl-1-(2-pyridyl)pyrazol-4-yl]acrylic acid Formula: C20H18FN3O2 MolecularWeight: 351.374223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=C1C=CC(=O)O)C2=CC=C(C=C2)F)C3=CC=CC=N3

Isomeric SMILES

CC(C)C1=NN(C(=C1/C=C/C(=O)O)C2=CC=C(C=C2)F)C3=CC=CC=N3

InChI

InChI=1S/C20H18FN3O2/c1-13(2)19-16(10-11-18(25)26)20(14-6-8-15(21)9-7-14)24(23-19)17-5-3-4-12-22-17/h3-13H,1-2H3,(H,25,26)/b11-10+