(E)-4-(2,3,3-trimethylcyclohexen-1-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2,3,3-trimethylcyclohexen-1-yl)but-3-en-2-one Openeye Name: (E)-4-(2,3,3-trimethylcyclohexen-1-yl)but-3-en-2-one CAS Name: (E)-4-(2,3,3-trimethyl-1-cyclohexenyl)-3-buten-2-one IUPAC Name: (E)-4-(2,3,3-trimethylcyclohexen-1-yl)but-3-en-2-one Traditional Name: (E)-4-(2,3,3-trimethylcyclohexen-1-yl)but-3-en-2-one Formula: C13H20O MolecularWeight: 192.2973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCCC1(C)C)C=CC(=O)C

Isomeric SMILES

CC1=C(CCCC1(C)C)/C=C/C(=O)C

InChI

InChI=1S/C13H20O/c1-10(14)7-8-12-6-5-9-13(3,4)11(12)2/h7-8H,5-6,9H2,1-4H3/b8-7+