(4S)-2-cyclopropylcarbonyl-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one

Systemtic Name: (4S)-2-cyclopropylcarbonyl-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one Openeye Name: (4S)-2-(cyclopropanecarbonyl)-5-methyl-4-(2-methylallyl)-4H-pyrazol-3-one CAS Name: (4S)-2-[cyclopropyl(oxo)methyl]-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one IUPAC Name: (4S)-2-(cyclopropanecarbonyl)-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one Traditional Name: (4S)-2-(cyclopropanecarbonyl)-5-methyl-4-(2-methylallyl)-2-pyrazolin-3-one Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CC(=C)C)C(=O)C2CC2

Isomeric SMILES

CC1=NN(C(=O)[C@H]1CC(=C)C)C(=O)C2CC2

InChI

InChI=1S/C12H16N2O2/c1-7(2)6-10-8(3)13-14(12(10)16)11(15)9-4-5-9/h9-10H,1,4-6H2,2-3H3/t10-/m0/s1