1-[5-(methylsulfanylmethyl)furan-2-yl]carbonylpiperidine-2-carboxylic acid

Systemtic Name: 1-[5-(methylsulfanylmethyl)furan-2-yl]carbonylpiperidine-2-carboxylic acid Openeye Name: 1-[5-(methylsulfanylmethyl)furan-2-carbonyl]piperidine-2-carboxylic acid CAS Name: 1-[[5-[(methylthio)methyl]-2-furanyl]-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[5-(methylsulfanylmethyl)furan-2-carbonyl]piperidine-2-carboxylic acid Traditional Name: 1-[5-[(methylthio)methyl]-2-furoyl]pipecolinic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)C(=O)N2CCCCC2C(=O)O

Isomeric SMILES

CSCC1=CC=C(O1)C(=O)N2CCCCC2C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-19-8-9-5-6-11(18-9)12(15)14-7-3-2-4-10(14)13(16)17/h5-6,10H,2-4,7-8H2,1H3,(H,16,17)