4-[8-(2-octylcyclopropyl)octanoyl]-5-oxidanyl-thiophen-3-one

Systemtic Name: 4-[8-(2-octylcyclopropyl)octanoyl]-5-oxidanyl-thiophen-3-one Openeye Name: 5-hydroxy-4-[8-(2-octylcyclopropyl)octanoyl]thiophen-3-one CAS Name: 5-hydroxy-4-[8-(2-octylcyclopropyl)-1-oxooctyl]-3-thiophenone IUPAC Name: 5-hydroxy-4-[8-(2-octylcyclopropyl)octanoyl]thiophen-3-one Traditional Name: 5-hydroxy-4-[8-(2-octylcyclopropyl)octanoyl]thiophen-3-one Formula: C23H38O3S MolecularWeight: 394.61102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CC1CCCCCCCC(=O)C2=C(SCC2=O)O

Isomeric SMILES

CCCCCCCCC1CC1CCCCCCCC(=O)C2=C(SCC2=O)O

InChI

InChI=1S/C23H38O3S/c1-2-3-4-5-7-10-13-18-16-19(18)14-11-8-6-9-12-15-20(24)22-21(25)17-27-23(22)26/h18-19,26H,2-17H2,1H3