(2E,5E)-2,5-bis[(1-phenylpyrazol-4-yl)methylidene]cyclopentan-1-one

Systemtic Name: (2E,5E)-2,5-bis[(1-phenylpyrazol-4-yl)methylidene]cyclopentan-1-one Openeye Name: (2E,5E)-2,5-bis[(1-phenylpyrazol-4-yl)methylene]cyclopentanone CAS Name: (2E,5E)-2,5-bis[(1-phenyl-4-pyrazolyl)methylidene]-1-cyclopentanone IUPAC Name: (2E,5E)-2,5-bis[(1-phenylpyrazol-4-yl)methylidene]cyclopentan-1-one Traditional Name: (2E,5E)-2,5-bis[(1-phenylpyrazol-4-yl)methylene]cyclopentanone Formula: C25H20N4O MolecularWeight: 392.4525

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CN(N=C2)C3=CC=CC=C3)C(=O)C1=CC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1/C(=C\C2=CN(N=C2)C3=CC=CC=C3)/C(=O)/C(=C/C4=CN(N=C4)C5=CC=CC=C5)/C1

InChI

InChI=1S/C25H20N4O/c30-25-21(13-19-15-26-28(17-19)23-7-3-1-4-8-23)11-12-22(25)14-20-16-27-29(18-20)24-9-5-2-6-10-24/h1-10,13-18H,11-12H2/b21-13+,22-14+