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

Systemtic Name: 4-[(E)-but-2-enoyl]-5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-[(E)-but-2-enoyl]-5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-1H-pyrazol-3-one CAS Name: 4-[(E)-1-oxobut-2-enyl]-5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-[(E)-but-2-enoyl]-5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-[(E)-but-2-enoyl]-5-[(1E,3E)-penta-1,3-dienyl]-2-phenyl-3-pyrazolin-3-one Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(=O)C=CC

Isomeric SMILES

C/C=C/C=C/C1=C(C(=O)N(N1)C2=CC=CC=C2)C(=O)/C=C/C

InChI

InChI=1S/C18H18N2O2/c1-3-5-7-13-15-17(16(21)10-4-2)18(22)20(19-15)14-11-8-6-9-12-14/h3-13,19H,1-2H3/b5-3+,10-4+,13-7+