4,5-dipentyl-3,4-dihydro-2H-thiopyran-2-carboxylic acid

Systemtic Name: 4,5-dipentyl-3,4-dihydro-2H-thiopyran-2-carboxylic acid Openeye Name: 4,5-dipentyl-3,4-dihydro-2H-thiopyran-2-carboxylic acid CAS Name: 4,5-dipentyl-3,4-dihydro-2H-thiopyran-2-carboxylic acid IUPAC Name: 4,5-dipentyl-3,4-dihydro-2H-thiopyran-2-carboxylic acid Traditional Name: 4,5-diamyl-3,4-dihydro-2H-thiopyran-2-carboxylic acid Formula: C16H28O2S MolecularWeight: 284.45732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(SC=C1CCCCC)C(=O)O

Isomeric SMILES

CCCCCC1CC(SC=C1CCCCC)C(=O)O

InChI

InChI=1S/C16H28O2S/c1-3-5-7-9-13-11-15(16(17)18)19-12-14(13)10-8-6-4-2/h12-13,15H,3-11H2,1-2H3,(H,17,18)