5-[(E)-but-2-en-2-yl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-[(E)-but-2-en-2-yl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-[(E)-1-methylprop-1-enyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-[(E)-but-2-en-2-yl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-[(E)-but-2-en-2-yl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-[(E)-1-methylprop-1-enyl]-2-phenyl-2-pyrazolin-3-one Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O/c1-3-10(2)12-9-13(16)15(14-12)11-7-5-4-6-8-11/h3-8H,9H2,1-2H3/b10-3+