(E)-4-(2,4,4-trimethylcyclohexa-1,5-dien-1-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2,4,4-trimethylcyclohexa-1,5-dien-1-yl)but-3-en-2-one Openeye Name: (E)-4-(2,4,4-trimethylcyclohexa-1,5-dien-1-yl)but-3-en-2-one CAS Name: (E)-4-(2,4,4-trimethyl-1-cyclohexa-1,5-dienyl)-3-buten-2-one IUPAC Name: (E)-4-(2,4,4-trimethylcyclohexa-1,5-dien-1-yl)but-3-en-2-one Traditional Name: (E)-4-(2,4,4-trimethylcyclohexa-1,5-dien-1-yl)but-3-en-2-one Formula: C13H18O MolecularWeight: 190.28142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(C1)(C)C)C=CC(=O)C

Isomeric SMILES

CC1=C(C=CC(C1)(C)C)/C=C/C(=O)C

InChI

InChI=1S/C13H18O/c1-10-9-13(3,4)8-7-12(10)6-5-11(2)14/h5-8H,9H2,1-4H3/b6-5+