5-methyl-2-propan-2-yl-1H-pyrazol-3-one

Systemtic Name: 5-methyl-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 2-isopropyl-5-methyl-1H-pyrazol-3-one CAS Name: 5-methyl-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 5-methyl-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 2-isopropyl-5-methyl-3-pyrazolin-3-one Formula: C7H12N2O MolecularWeight: 140.18298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H12N2O/c1-5(2)9-7(10)4-6(3)8-9/h4-5,8H,1-3H3