methyl (1R,2S,5S,6R)-6-methyl-2-(3-methylbutyl)-5-oxidanyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,2S,5S,6R)-6-methyl-2-(3-methylbutyl)-5-oxidanyl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,2S,5S,6R)-5-hydroxy-2-isopentyl-6-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,2S,5S,6R)-5-hydroxy-6-methyl-2-(3-methylbutyl)-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S,5S,6R)-5-hydroxy-6-methyl-2-(3-methylbutyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1R,2S,5S,6R)-5-hydroxy-2-isoamyl-6-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C14H24O3 MolecularWeight: 240.33856

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C=CC(C1C(=O)OC)CCC(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C14H24O3/c1-9(2)5-6-11-7-8-12(15)10(3)13(11)14(16)17-4/h7-13,15H,5-6H2,1-4H3/t10-,11-,12-,13-/m0/s1