(2S,5R)-2-fluoranyl-2-methyl-5-(2,2,4-trimethyl-1,3-dioxolan-4-yl)cyclohexan-1-one

Systemtic Name: (2S,5R)-2-fluoranyl-2-methyl-5-(2,2,4-trimethyl-1,3-dioxolan-4-yl)cyclohexan-1-one Openeye Name: (2S,5R)-2-fluoro-2-methyl-5-(2,2,4-trimethyl-1,3-dioxolan-4-yl)cyclohexanone CAS Name: (2S,5R)-2-fluoro-2-methyl-5-(2,2,4-trimethyl-1,3-dioxolan-4-yl)-1-cyclohexanone IUPAC Name: (2S,5R)-2-fluoro-2-methyl-5-(2,2,4-trimethyl-1,3-dioxolan-4-yl)cyclohexan-1-one Traditional Name: (2S,5R)-2-fluoro-2-methyl-5-(2,2,4-trimethyl-1,3-dioxolan-4-yl)cyclohexanone Formula: C13H21FO3 MolecularWeight: 244.302443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)(C)C2CCC(C(=O)C2)(C)F)C

Isomeric SMILES

C[C@@]1(CC[C@H](CC1=O)C2(COC(O2)(C)C)C)F

InChI

InChI=1S/C13H21FO3/c1-11(2)16-8-13(4,17-11)9-5-6-12(3,14)10(15)7-9/h9H,5-8H2,1-4H3/t9-,12+,13?/m1/s1