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

Systemtic Name: ethyl (2S)-2-methyl-3-[(1S,2S)-2-oxidanylcyclohexyl]oxy-2-propan-2-yl-but-3-enoate Openeye Name: ethyl (2S)-3-[(1S,2S)-2-hydroxycyclohexoxy]-2-isopropyl-2-methyl-but-3-enoate CAS Name: (2S)-3-[(1S,2S)-2-hydroxycyclohexyl]oxy-2-methyl-2-propan-2-yl-3-butenoic acid ethyl ester IUPAC Name: ethyl (2S)-3-[(1S,2S)-2-hydroxycyclohexyl]oxy-2-methyl-2-propan-2-ylbut-3-enoate Traditional Name: (2S)-3-[(1S,2S)-2-hydroxycyclohexoxy]-2-isopropyl-2-methyl-but-3-enoic acid ethyl ester Formula: C16H28O4 MolecularWeight: 284.39112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(C)C)C(=C)OC1CCCCC1O

Isomeric SMILES

CCOC(=O)[C@@](C)(C(C)C)C(=C)O[C@H]1CCCC[C@@H]1O

InChI

InChI=1S/C16H28O4/c1-6-19-15(18)16(5,11(2)3)12(4)20-14-10-8-7-9-13(14)17/h11,13-14,17H,4,6-10H2,1-3,5H3/t13-,14-,16-/m0/s1