3,3-dimethyl-1-pyrazol-1-yl-butan-2-one

Systemtic Name: 3,3-dimethyl-1-pyrazol-1-yl-butan-2-one Openeye Name: 3,3-dimethyl-1-pyrazol-1-yl-butan-2-one CAS Name: 3,3-dimethyl-1-(1-pyrazolyl)-2-butanone IUPAC Name: 3,3-dimethyl-1-pyrazol-1-ylbutan-2-one Traditional Name: 3,3-dimethyl-1-pyrazol-1-yl-butan-2-one Formula: C9H14N2O MolecularWeight: 166.22026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C=CC=N1

Isomeric SMILES

CC(C)(C)C(=O)CN1C=CC=N1

InChI

InChI=1S/C9H14N2O/c1-9(2,3)8(12)7-11-6-4-5-10-11/h4-6H,7H2,1-3H3