5,5,6-trimethylundec-3-yne-2,2-diol

Systemtic Name: 5,5,6-trimethylundec-3-yne-2,2-diol Openeye Name: 5,5,6-trimethylundec-3-yne-2,2-diol CAS Name: 5,5,6-trimethyl-3-undecyne-2,2-diol IUPAC Name: 5,5,6-trimethylundec-3-yne-2,2-diol Traditional Name: 5,5,6-trimethylundec-3-yne-2,2-diol Formula: C14H26O2 MolecularWeight: 226.35504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C(C)(C)C#CC(C)(O)O

Isomeric SMILES

CCCCCC(C)C(C)(C)C#CC(C)(O)O

InChI

InChI=1S/C14H26O2/c1-6-7-8-9-12(2)13(3,4)10-11-14(5,15)16/h12,15-16H,6-9H2,1-5H3