[(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-oxidanylideneoct-7-enoate

Systemtic Name: [(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-oxidanylideneoct-7-enoate Openeye Name: [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 3-oxooct-7-enoate CAS Name: 3-oxo-7-octenoic acid [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxooct-7-enoate Traditional Name: 3-ketooct-7-enoic acid [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C18H30O3 MolecularWeight: 294.429

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CC(=O)CCCC=C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@H](C1)OC(=O)CC(=O)CCCC=C)C(C)C

InChI

InChI=1S/C18H30O3/c1-5-6-7-8-15(19)12-18(20)21-17-11-14(4)9-10-16(17)13(2)3/h5,13-14,16-17H,1,6-12H2,2-4H3/t14-,16+,17+/m1/s1