(E)-1-(3,3-dimethylcyclohexyl)but-2-en-1-one

Systemtic Name: (E)-1-(3,3-dimethylcyclohexyl)but-2-en-1-one Openeye Name: (E)-1-(3,3-dimethylcyclohexyl)but-2-en-1-one CAS Name: (E)-1-(3,3-dimethylcyclohexyl)-2-buten-1-one IUPAC Name: (E)-1-(3,3-dimethylcyclohexyl)but-2-en-1-one Traditional Name: (E)-1-(3,3-dimethylcyclohexyl)but-2-en-1-one Formula: C12H20O MolecularWeight: 180.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C1CCCC(C1)(C)C

Isomeric SMILES

C/C=C/C(=O)C1CCCC(C1)(C)C

InChI

InChI=1S/C12H20O/c1-4-6-11(13)10-7-5-8-12(2,3)9-10/h4,6,10H,5,7-9H2,1-3H3/b6-4+