ethyl (2S)-2-ethyl-3-[(1S,2S)-2-oxidanylcyclohexyl]oxy-2-propan-2-yl-but-3-enoate

Systemtic Name: ethyl (2S)-2-ethyl-3-[(1S,2S)-2-oxidanylcyclohexyl]oxy-2-propan-2-yl-but-3-enoate Openeye Name: ethyl (2S)-2-ethyl-3-[(1S,2S)-2-hydroxycyclohexoxy]-2-isopropyl-but-3-enoate CAS Name: (2S)-2-ethyl-3-[(1S,2S)-2-hydroxycyclohexyl]oxy-2-propan-2-yl-3-butenoic acid ethyl ester IUPAC Name: ethyl (2S)-2-ethyl-3-[(1S,2S)-2-hydroxycyclohexyl]oxy-2-propan-2-ylbut-3-enoate Traditional Name: (2S)-2-ethyl-3-[(1S,2S)-2-hydroxycyclohexoxy]-2-isopropyl-but-3-enoic acid ethyl ester Formula: C17H30O4 MolecularWeight: 298.4177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C)(C(=C)OC1CCCCC1O)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C17H30O4/c1-6-17(12(3)4,16(19)20-7-2)13(5)21-15-11-9-8-10-14(15)18/h12,14-15,18H,5-11H2,1-4H3/t14-,15-,17-/m0/s1