(1R,3S,6S)-3,6-dibutylcyclohex-4-ene-1,3-diol

Systemtic Name: (1R,3S,6S)-3,6-dibutylcyclohex-4-ene-1,3-diol Openeye Name: (1R,3S,6S)-3,6-dibutylcyclohex-4-ene-1,3-diol CAS Name: (1R,3S,6S)-3,6-dibutylcyclohex-4-ene-1,3-diol IUPAC Name: (1R,3S,6S)-3,6-dibutylcyclohex-4-ene-1,3-diol Traditional Name: (1R,3S,6S)-3,6-dibutylcyclohex-4-ene-1,3-diol Formula: C14H26O2 MolecularWeight: 226.35504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=CC(CC1O)(CCCC)O

Isomeric SMILES

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

InChI

InChI=1S/C14H26O2/c1-3-5-7-12-8-10-14(16,9-6-4-2)11-13(12)15/h8,10,12-13,15-16H,3-7,9,11H2,1-2H3/t12-,13+,14+/m0/s1