1,3-bis(2,5,5-trimethyl-3-bicyclo[2.2.2]octanyl)propan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CCC(C1CCC(=O)C3C(C4CCC3C(C4)(C)C)C)C(C2)(C)C

Isomeric SMILES

CC1C2CCC(C1CCC(=O)C3C(C4CCC3C(C4)(C)C)C)C(C2)(C)C

InChI

InChI=1S/C25H42O/c1-15-17-7-10-20(24(3,4)13-17)19(15)9-12-22(26)23-16(2)18-8-11-21(23)25(5,6)14-18/h15-21,23H,7-14H2,1-6H3