(4R)-3,4-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1H-pyrazol-5-one

Systemtic Name: (4R)-3,4-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1H-pyrazol-5-one Openeye Name: (4R)-4-[(E)-cinnamyl]-3,4-dimethyl-1H-pyrazol-5-one CAS Name: (4R)-3,4-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1H-pyrazol-5-one IUPAC Name: (4R)-3,4-dimethyl-4-[(E)-3-phenylprop-2-enyl]-1H-pyrazol-5-one Traditional Name: (4R)-4-[(E)-cinnamyl]-4,5-dimethyl-2-pyrazolin-3-one Formula: C14H16N2O MolecularWeight: 228.28964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C1(C)CC=CC2=CC=CC=C2

Isomeric SMILES

CC1=NNC(=O)[C@]1(C)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O/c1-11-14(2,13(17)16-15-11)10-6-9-12-7-4-3-5-8-12/h3-9H,10H2,1-2H3,(H,16,17)/b9-6+/t14-/m1/s1