7-[3-(butylsulfanylmethyl)-7-thiabicyclo[2.2.1]heptan-2-yl]heptanoic acid

Systemtic Name: 7-[3-(butylsulfanylmethyl)-7-thiabicyclo[2.2.1]heptan-2-yl]heptanoic acid Openeye Name: 7-[3-(butylsulfanylmethyl)-7-thiabicyclo[2.2.1]heptan-2-yl]heptanoic acid CAS Name: 7-[3-[(butylthio)methyl]-7-thiabicyclo[2.2.1]heptan-2-yl]heptanoic acid IUPAC Name: 7-[3-(butylsulfanylmethyl)-7-thiabicyclo[2.2.1]heptan-2-yl]heptanoic acid Traditional Name: 7-[3-[(butylthio)methyl]-7-thiabicyclo[2.2.1]heptan-2-yl]enanthic acid Formula: C18H32O2S2 MolecularWeight: 344.57548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1C2CCC(C1CCCCCCC(=O)O)S2

Isomeric SMILES

CCCCSCC1C2CCC(C1CCCCCCC(=O)O)S2

InChI

InChI=1S/C18H32O2S2/c1-2-3-12-21-13-15-14(16-10-11-17(15)22-16)8-6-4-5-7-9-18(19)20/h14-17H,2-13H2,1H3,(H,19,20)