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

Systemtic Name: (E)-1-(1-benzofuran-2-yl)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-1-(benzofuran-2-yl)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(2-benzofuranyl)-3-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(1-benzofuran-2-yl)-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-en-1-one Traditional Name: (E)-1-(benzofuran-2-yl)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Formula: C27H20N2O3 MolecularWeight: 420.4593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C/C(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2O3/c1-31-23-14-11-19(12-15-23)27-21(18-29(28-27)22-8-3-2-4-9-22)13-16-24(30)26-17-20-7-5-6-10-25(20)32-26/h2-18H,1H3/b16-13+