(E)-1-(2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one

Systemtic Name: (E)-1-(2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one Openeye Name: (E)-1-(2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one CAS Name: (E)-1-(2,6,6-trimethyl-1-cyclohexenyl)-2-buten-1-one IUPAC Name: (E)-1-(2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one Traditional Name: (E)-1-(2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one Formula: C13H20O MolecularWeight: 192.2973

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C1=C(CCCC1(C)C)C

Isomeric SMILES

C/C=C/C(=O)C1=C(CCCC1(C)C)C

InChI

InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7H,6,8-9H2,1-4H3/b7-5+