(4-cyclopentyl-4-oxidanyl-4-thiophen-2-yl-but-2-ynyl)-trimethyl-azanium

Systemtic Name: (4-cyclopentyl-4-oxidanyl-4-thiophen-2-yl-but-2-ynyl)-trimethyl-azanium Openeye Name: [4-cyclopentyl-4-hydroxy-4-(2-thienyl)but-2-ynyl]-trimethyl-ammonium CAS Name: (4-cyclopentyl-4-hydroxy-4-thiophen-2-ylbut-2-ynyl)-trimethylammonium IUPAC Name: (4-cyclopentyl-4-hydroxy-4-thiophen-2-ylbut-2-ynyl)-trimethylazanium Traditional Name: [4-cyclopentyl-4-hydroxy-4-(2-thienyl)but-2-ynyl]-trimethyl-ammonium Formula: C16H24NOS+ MolecularWeight: 278.43286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC#CC(C1CCCC1)(C2=CC=CS2)O

Isomeric SMILES

C[N+](C)(C)CC#CC(C1CCCC1)(C2=CC=CS2)O

InChI

InChI=1S/C16H24NOS/c1-17(2,3)12-7-11-16(18,14-8-4-5-9-14)15-10-6-13-19-15/h6,10,13-14,18H,4-5,8-9,12H2,1-3H3/q+1