(6R,7S)-6-methyl-7-(3-oxidanylidenebutyl)cyclohept-2-en-1-one

Systemtic Name: (6R,7S)-6-methyl-7-(3-oxidanylidenebutyl)cyclohept-2-en-1-one Openeye Name: (6R,7S)-6-methyl-7-(3-oxobutyl)cyclohept-2-en-1-one CAS Name: (6R,7S)-6-methyl-7-(3-oxobutyl)-1-cyclohept-2-enone IUPAC Name: (6R,7S)-6-methyl-7-(3-oxobutyl)cyclohept-2-en-1-one Traditional Name: (6R,7S)-7-(3-ketobutyl)-6-methyl-cyclohept-2-en-1-one Formula: C12H18O2 MolecularWeight: 194.27012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC=CC(=O)C1CCC(=O)C

Isomeric SMILES

C[C@@H]1CCC=CC(=O)[C@H]1CCC(=O)C

InChI

InChI=1S/C12H18O2/c1-9-5-3-4-6-12(14)11(9)8-7-10(2)13/h4,6,9,11H,3,5,7-8H2,1-2H3/t9-,11+/m1/s1