1-(1-benzofuran-2-yl)-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: 1-(1-benzofuran-2-yl)-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: 1-(benzofuran-2-yl)-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one CAS Name: 1-(2-benzofuranyl)-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-2-propen-1-one IUPAC Name: 1-(1-benzofuran-2-yl)-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]prop-2-en-1-one Traditional Name: 1-(benzofuran-2-yl)-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Formula: C28H20N2O4 MolecularWeight: 448.4694

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=CC(=O)C4=CC5=CC=CC=C5O4)C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=CC(=O)C4=CC5=CC=CC=C5O4)C6=CC=CC=C6

InChI

InChI=1S/C28H20N2O4/c31-23(26-16-19-6-4-5-9-24(19)34-26)12-10-21-18-30(22-7-2-1-3-8-22)29-28(21)20-11-13-25-27(17-20)33-15-14-32-25/h1-13,16-18H,14-15H2