[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S,3S)-3-ethenyl-2-oxidanyl-2-prop-1-en-2-yl-hexanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S,3S)-3-ethenyl-2-oxidanyl-2-prop-1-en-2-yl-hexanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2S,3S)-2-hydroxy-2-isopropenyl-3-vinyl-hexanoate CAS Name: (2S,3S)-3-ethenyl-2-hydroxy-2-(1-methylethenyl)hexanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S,3S)-3-ethenyl-2-hydroxy-2-prop-1-en-2-ylhexanoate Traditional Name: (2S,3S)-2-hydroxy-2-isopropenyl-3-propyl-pent-4-enoic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=C)C(C(=C)C)(C(=O)OC1CC(CCC1C(C)C)C)O

Isomeric SMILES

CCC[C@@H](C=C)[C@](C(=C)C)(C(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C)O

InChI

InChI=1S/C21H36O3/c1-8-10-17(9-2)21(23,15(5)6)20(22)24-19-13-16(7)11-12-18(19)14(3)4/h9,14,16-19,23H,2,5,8,10-13H2,1,3-4,6-7H3/t16-,17-,18+,19-,21-/m1/s1