3-(4-cyanobutylsulfanyl)propanoic acid

Systemtic Name: 3-(4-cyanobutylsulfanyl)propanoic acid Openeye Name: 3-(4-cyanobutylsulfanyl)propanoic acid CAS Name: 3-(4-cyanobutylthio)propanoic acid IUPAC Name: 3-(4-cyanobutylsulfanyl)propanoic acid Traditional Name: 3-(4-cyanobutylthio)propionic acid Formula: C8H13NO2S MolecularWeight: 187.25932

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Descriptors Computed from Structure

Canonical SMILES:

C(CCSCCC(=O)O)CC#N

Isomeric SMILES

C(CCSCCC(=O)O)CC#N

InChI

InChI=1S/C8H13NO2S/c9-5-2-1-3-6-12-7-4-8(10)11/h1-4,6-7H2,(H,10,11)