6-[(1S,2R)-2-oct-4-ynylcyclopentyl]hexanoate

Systemtic Name: 6-[(1S,2R)-2-oct-4-ynylcyclopentyl]hexanoate Openeye Name: 6-[(1S,2R)-2-oct-4-ynylcyclopentyl]hexanoate CAS Name: 6-[(1S,2R)-2-oct-4-ynylcyclopentyl]hexanoate IUPAC Name: 6-[(1S,2R)-2-oct-4-ynylcyclopentyl]hexanoate Traditional Name: 6-[(1S,2R)-2-oct-4-ynylcyclopentyl]hexanoate Formula: C19H31O2- MolecularWeight: 291.44824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCCCC1CCCC1CCCCCC(=O)[O-]

Isomeric SMILES

CCCC#CCCC[C@H]1CCC[C@@H]1CCCCCC(=O)[O-]

InChI

InChI=1S/C19H32O2/c1-2-3-4-5-6-8-12-17-14-11-15-18(17)13-9-7-10-16-19(20)21/h17-18H,2-3,6-16H2,1H3,(H,20,21)/p-1/t17-,18-/m0/s1