(1S,2R,6aS)-2-ethyl-3-hexyl-4,5,6,6a-tetrahydro-1H-pentalene-1,2-diol

Systemtic Name: (1S,2R,6aS)-2-ethyl-3-hexyl-4,5,6,6a-tetrahydro-1H-pentalene-1,2-diol Openeye Name: (1S,2R,6aS)-2-ethyl-3-hexyl-4,5,6,6a-tetrahydro-1H-pentalene-1,2-diol CAS Name: (1S,2R,6aS)-2-ethyl-3-hexyl-4,5,6,6a-tetrahydro-1H-pentalene-1,2-diol IUPAC Name: (1S,2R,6aS)-2-ethyl-3-hexyl-4,5,6,6a-tetrahydro-1H-pentalene-1,2-diol Traditional Name: (1S,2R,6aS)-2-ethyl-3-hexyl-4,5,6,6a-tetrahydro-1H-pentalene-1,2-diol Formula: C16H28O2 MolecularWeight: 252.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2CCCC2C(C1(CC)O)O

Isomeric SMILES

CCCCCCC1=C2CCC[C@@H]2[C@@H]([C@]1(CC)O)O

InChI

InChI=1S/C16H28O2/c1-3-5-6-7-11-14-12-9-8-10-13(12)15(17)16(14,18)4-2/h13,15,17-18H,3-11H2,1-2H3/t13-,15-,16+/m0/s1