5-methyl-2-phenyl-4-prop-2-enyl-1H-pyrazol-3-one

Systemtic Name: 5-methyl-2-phenyl-4-prop-2-enyl-1H-pyrazol-3-one Openeye Name: 4-allyl-5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 5-methyl-2-phenyl-4-prop-2-enyl-1H-pyrazol-3-one IUPAC Name: 5-methyl-2-phenyl-4-prop-2-enyl-1H-pyrazol-3-one Traditional Name: 4-allyl-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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