1,5-bis(3,3-dimethyl-2-bicyclo[2.2.2]octanyl)pentan-3-one

Systemtic Name: 1,5-bis(3,3-dimethyl-2-bicyclo[2.2.2]octanyl)pentan-3-one Openeye Name: 1,5-bis(3,3-dimethyl-2-bicyclo[2.2.2]octanyl)pentan-3-one CAS Name: 1,5-bis(3,3-dimethyl-2-bicyclo[2.2.2]octanyl)-3-pentanone IUPAC Name: 1,5-bis(3,3-dimethyl-2-bicyclo[2.2.2]octanyl)pentan-3-one Traditional Name: 1,5-bis(3,3-dimethyl-2-bicyclo[2.2.2]octanyl)pentan-3-one Formula: C25H42O MolecularWeight: 358.60038

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(C1CCC(=O)CCC3C4CCC(C3(C)C)CC4)CC2)C

Isomeric SMILES

CC1(C2CCC(C1CCC(=O)CCC3C4CCC(C3(C)C)CC4)CC2)C

InChI

InChI=1S/C25H42O/c1-24(2)19-9-5-17(6-10-19)22(24)15-13-21(26)14-16-23-18-7-11-20(12-8-18)25(23,3)4/h17-20,22-23H,5-16H2,1-4H3