1-(2-chloranyl-5-methylsulfanyl-phenyl)carbonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(2-chloranyl-5-methylsulfanyl-phenyl)carbonylpiperidine-2-carboxylic acid Openeye Name: 1-(2-chloro-5-methylsulfanyl-benzoyl)piperidine-2-carboxylic acid CAS Name: 1-[[2-chloro-5-(methylthio)phenyl]-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-(2-chloro-5-methylsulfanylbenzoyl)piperidine-2-carboxylic acid Traditional Name: 1-[2-chloro-5-(methylthio)benzoyl]pipecolinic acid Formula: C14H16ClNO3S MolecularWeight: 313.79974

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCCCC2C(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCCCC2C(=O)O

InChI

InChI=1S/C14H16ClNO3S/c1-20-9-5-6-11(15)10(8-9)13(17)16-7-3-2-4-12(16)14(18)19/h5-6,8,12H,2-4,7H2,1H3,(H,18,19)