4-[(1R,2E)-2-(methoxymethylidene)-1-methyl-cyclohexyl]butan-2-one

Systemtic Name: 4-[(1R,2E)-2-(methoxymethylidene)-1-methyl-cyclohexyl]butan-2-one Openeye Name: 4-[(1R,2E)-2-(methoxymethylene)-1-methyl-cyclohexyl]butan-2-one CAS Name: 4-[(1R,2E)-2-(methoxymethylidene)-1-methylcyclohexyl]-2-butanone IUPAC Name: 4-[(1R,2E)-2-(methoxymethylidene)-1-methylcyclohexyl]butan-2-one Traditional Name: 4-[(1R,2E)-2-(methoxymethylene)-1-methyl-cyclohexyl]butan-2-one Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1(CCCCC1=COC)C

Isomeric SMILES

CC(=O)CC[C@]\1(CCCC/C1=C\OC)C

InChI

InChI=1S/C13H22O2/c1-11(14)7-9-13(2)8-5-4-6-12(13)10-15-3/h10H,4-9H2,1-3H3/b12-10+/t13-/m1/s1