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

Systemtic Name: 1-imidazol-1-yl-3,3-dimethyl-butan-2-one Openeye Name: 1-imidazol-1-yl-3,3-dimethyl-butan-2-one CAS Name: 1-(1-imidazolyl)-3,3-dimethyl-2-butanone IUPAC Name: 1-imidazol-1-yl-3,3-dimethylbutan-2-one Traditional Name: 1-imidazol-1-yl-3,3-dimethyl-butan-2-one Formula: C9H14N2O MolecularWeight: 166.22026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C=CN=C1

Isomeric SMILES

CC(C)(C)C(=O)CN1C=CN=C1

InChI

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