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

Systemtic Name: 3-methyl-1-(2,4,4-trimethylcyclohexen-1-yl)but-2-en-1-one Openeye Name: 3-methyl-1-(2,4,4-trimethylcyclohexen-1-yl)but-2-en-1-one CAS Name: 3-methyl-1-(2,4,4-trimethyl-1-cyclohexenyl)-2-buten-1-one IUPAC Name: 3-methyl-1-(2,4,4-trimethylcyclohexen-1-yl)but-2-en-1-one Traditional Name: 3-methyl-1-(2,4,4-trimethylcyclohexen-1-yl)but-2-en-1-one Formula: C14H22O MolecularWeight: 206.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC(C1)(C)C)C(=O)C=C(C)C

Isomeric SMILES

CC1=C(CCC(C1)(C)C)C(=O)C=C(C)C

InChI

InChI=1S/C14H22O/c1-10(2)8-13(15)12-6-7-14(4,5)9-11(12)3/h8H,6-7,9H2,1-5H3