(E)-1-(6,6-dimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one

Systemtic Name: (E)-1-(6,6-dimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one Openeye Name: (E)-1-(6,6-dimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one CAS Name: (E)-1-(6,6-dimethyl-1-cyclohexa-1,3-dienyl)-2-buten-1-one IUPAC Name: (E)-1-(6,6-dimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one Traditional Name: (E)-1-(6,6-dimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one Formula: C12H16O MolecularWeight: 176.25484

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C1=CC=CCC1(C)C

Isomeric SMILES

C/C=C/C(=O)C1=CC=CCC1(C)C

InChI

InChI=1S/C12H16O/c1-4-7-11(13)10-8-5-6-9-12(10,2)3/h4-8H,9H2,1-3H3/b7-4+