1-chloranyl-4-(5-penta-1,3-diynylthiophen-2-yl)but-3-yn-2-ol

Systemtic Name: 1-chloranyl-4-(5-penta-1,3-diynylthiophen-2-yl)but-3-yn-2-ol Openeye Name: 1-chloro-4-(5-penta-1,3-diynyl-2-thienyl)but-3-yn-2-ol CAS Name: 1-chloro-4-(5-penta-1,3-diynyl-2-thiophenyl)-3-butyn-2-ol IUPAC Name: 1-chloro-4-(5-penta-1,3-diynylthiophen-2-yl)but-3-yn-2-ol Traditional Name: 1-chloro-4-(5-penta-1,3-diynyl-2-thienyl)but-3-yn-2-ol Formula: C13H9ClOS MolecularWeight: 248.72796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC#CC1=CC=C(S1)C#CC(CCl)O

Isomeric SMILES

CC#CC#CC1=CC=C(S1)C#CC(CCl)O

InChI

InChI=1S/C13H9ClOS/c1-2-3-4-5-12-8-9-13(16-12)7-6-11(15)10-14/h8-9,11,15H,10H2,1H3