1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylic acid Openeye Name: 1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylic acid CAS Name: 1-[3-(methylthio)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylic acid Traditional Name: 1-[3-(methylthio)propanoyl]isonipecotic acid Formula: C10H17NO3S MolecularWeight: 231.31188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCC(CC1)C(=O)O

Isomeric SMILES

CSCCC(=O)N1CCC(CC1)C(=O)O

InChI

InChI=1S/C10H17NO3S/c1-15-7-4-9(12)11-5-2-8(3-6-11)10(13)14/h8H,2-7H2,1H3,(H,13,14)