[(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2S)-6-oxidanylideneoxan-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate

Systemtic Name: [(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2S)-6-oxidanylideneoxan-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate Openeye Name: [(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2S)-6-oxotetrahydropyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate CAS Name: (2S)-2-methylbutanoic acid [(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2S)-6-oxo-2-oxanyl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester IUPAC Name: [(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2S)-6-oxooxan-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate Traditional Name: (2S)-2-methylbutyric acid [(1S,3R,7S,8S,8aR)-8-[2-[(2S)-6-ketotetrahydropyran-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester Formula: C24H36O4 MolecularWeight: 388.54024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CCCC(=O)O3)C

Isomeric SMILES

CC[C@H](C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3CCCC(=O)O3)C

InChI

InChI=1S/C24H36O4/c1-5-16(3)24(26)28-21-14-15(2)13-18-10-9-17(4)20(23(18)21)12-11-19-7-6-8-22(25)27-19/h9-10,13,15-17,19-21,23H,5-8,11-12,14H2,1-4H3/t15-,16-,17-,19-,20-,21-,23-/m0/s1