7-(2-butylsulfanylethanoylamino)heptanoic acid

Systemtic Name: 7-(2-butylsulfanylethanoylamino)heptanoic acid Openeye Name: 7-[(2-butylsulfanylacetyl)amino]heptanoic acid CAS Name: 7-[[2-(butylthio)-1-oxoethyl]amino]heptanoic acid IUPAC Name: 7-[(2-butylsulfanylacetyl)amino]heptanoic acid Traditional Name: 7-[[2-(butylthio)acetyl]amino]enanthic acid Formula: C13H25NO3S MolecularWeight: 275.4075

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NCCCCCCC(=O)O

Isomeric SMILES

CCCCSCC(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C13H25NO3S/c1-2-3-10-18-11-12(15)14-9-7-5-4-6-8-13(16)17/h2-11H2,1H3,(H,14,15)(H,16,17)