(2E)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylidene]-3H-inden-1-one

Systemtic Name: (2E)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylidene]-3H-inden-1-one Openeye Name: (2E)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylene]indan-1-one CAS Name: (2E)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methylidene]-3H-inden-1-one IUPAC Name: (2E)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methylidene]-3H-inden-1-one Traditional Name: (2E)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylene]indan-1-one Formula: C27H20N2O3 MolecularWeight: 420.4593

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=C4CC5=CC=CC=C5C4=O)C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3/C=C/4\CC5=CC=CC=C5C4=O)C6=CC=CC=C6

InChI

InChI=1S/C27H20N2O3/c30-27-20(14-18-6-4-5-9-23(18)27)15-21-17-29(22-7-2-1-3-8-22)28-26(21)19-10-11-24-25(16-19)32-13-12-31-24/h1-11,15-17H,12-14H2/b20-15+