4-phenylmethoxydodec-6-yne-1,5-diol

Systemtic Name: 4-phenylmethoxydodec-6-yne-1,5-diol Openeye Name: 4-benzyloxydodec-6-yne-1,5-diol CAS Name: 4-phenylmethoxy-6-dodecyne-1,5-diol IUPAC Name: 4-phenylmethoxydodec-6-yne-1,5-diol Traditional Name: 4-benzoxydodec-6-yne-1,5-diol Formula: C19H28O3 MolecularWeight: 304.42382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC(C(CCCO)OCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCC#CC(C(CCCO)OCC1=CC=CC=C1)O

InChI

InChI=1S/C19H28O3/c1-2-3-4-5-9-13-18(21)19(14-10-15-20)22-16-17-11-7-6-8-12-17/h6-8,11-12,18-21H,2-5,10,14-16H2,1H3