5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-2-pyrazolin-3-one Formula: C14H14N2O MolecularWeight: 226.27376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC1=NN(C(=O)C1)C2=CC=CC=C2

Isomeric SMILES

C/C=C/C=C/C1=NN(C(=O)C1)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O/c1-2-3-5-8-12-11-14(17)16(15-12)13-9-6-4-7-10-13/h2-10H,11H2,1H3/b3-2+,8-5+