3-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-keto-2-[methyl-(4-methylcyclohexyl)amino]ethyl]thio]propionic acid Formula: C13H23NO3S MolecularWeight: 273.39162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N(C)C(=O)CSCCC(=O)O

Isomeric SMILES

CC1CCC(CC1)N(C)C(=O)CSCCC(=O)O

InChI

InChI=1S/C13H23NO3S/c1-10-3-5-11(6-4-10)14(2)12(15)9-18-8-7-13(16)17/h10-11H,3-9H2,1-2H3,(H,16,17)