3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(2-fluoranyl-4-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: 3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(2-fluoranyl-4-methoxy-phenyl)prop-2-en-1-one Openeye Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(2-fluoro-4-methoxy-phenyl)prop-2-en-1-one CAS Name: 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-1-(2-fluoro-4-methoxyphenyl)-2-propen-1-one IUPAC Name: 3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-1-(2-fluoro-4-methoxyphenyl)prop-2-en-1-one Traditional Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(2-fluoro-4-methoxy-phenyl)prop-2-en-1-one Formula: C27H19FN2O3 MolecularWeight: 438.449763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)F

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)F

InChI

InChI=1S/C27H19FN2O3/c1-32-21-12-13-22(23(28)16-21)24(31)14-11-19-17-30(20-8-3-2-4-9-20)29-27(19)26-15-18-7-5-6-10-25(18)33-26/h2-17H,1H3