1,5-dimethyl-2-phenyl-4-prop-2-enyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-2-phenyl-4-prop-2-enyl-pyrazol-3-one Openeye Name: 4-allyl-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-2-phenyl-4-prop-2-enyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-2-phenyl-4-prop-2-enylpyrazol-3-one Traditional Name: 4-allyl-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C14H16N2O MolecularWeight: 228.28964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CC=C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CC=C

InChI

InChI=1S/C14H16N2O/c1-4-8-13-11(2)15(3)16(14(13)17)12-9-6-5-7-10-12/h4-7,9-10H,1,8H2,2-3H3