(1S,4R,5S,6R)-5-[(3S)-3-cyclohexyl-3-oxidanyl-prop-1-ynyl]-4-oxidanyl-bicyclo[4.2.0]octan-8-one

Systemtic Name: (1S,4R,5S,6R)-5-[(3S)-3-cyclohexyl-3-oxidanyl-prop-1-ynyl]-4-oxidanyl-bicyclo[4.2.0]octan-8-one Openeye Name: (1S,4R,5S,6R)-5-[(3S)-3-cyclohexyl-3-hydroxy-prop-1-ynyl]-4-hydroxy-bicyclo[4.2.0]octan-8-one CAS Name: (1S,4R,5S,6R)-5-[(3S)-3-cyclohexyl-3-hydroxyprop-1-ynyl]-4-hydroxy-8-bicyclo[4.2.0]octanone IUPAC Name: (1S,4R,5S,6R)-5-[(3S)-3-cyclohexyl-3-hydroxyprop-1-ynyl]-4-hydroxybicyclo[4.2.0]octan-8-one Traditional Name: (1S,4R,5S,6R)-5-[(3S)-3-cyclohexyl-3-hydroxy-prop-1-ynyl]-4-hydroxy-bicyclo[4.2.0]octan-8-one Formula: C17H24O3 MolecularWeight: 276.37066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C#CC2C(CCC3C2CC3=O)O)O

Isomeric SMILES

C1CCC(CC1)[C@@H](C#C[C@H]2[C@@H](CC[C@H]3[C@@H]2CC3=O)O)O

InChI

InChI=1S/C17H24O3/c18-15(11-4-2-1-3-5-11)8-6-12-14-10-17(20)13(14)7-9-16(12)19/h11-16,18-19H,1-5,7,9-10H2/t12-,13+,14-,15-,16-/m1/s1