1-(2-tert-butylsulfanylethanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(2-tert-butylsulfanylethanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-[(2-tert-butylsulfanylacetyl)amino]cyclohexanecarboxylic acid CAS Name: 1-[[2-(tert-butylthio)-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(2-tert-butylsulfanylacetyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-(tert-butylthio)acetyl]amino]cyclohexanecarboxylic acid Formula: C13H23NO3S MolecularWeight: 273.39162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)NC1(CCCCC1)C(=O)O

Isomeric SMILES

CC(C)(C)SCC(=O)NC1(CCCCC1)C(=O)O

InChI

InChI=1S/C13H23NO3S/c1-12(2,3)18-9-10(15)14-13(11(16)17)7-5-4-6-8-13/h4-9H2,1-3H3,(H,14,15)(H,16,17)