5-pentylsulfanylfuran-2-carboxylic acid

Systemtic Name: 5-pentylsulfanylfuran-2-carboxylic acid Openeye Name: 5-pentylsulfanylfuran-2-carboxylic acid CAS Name: 5-(pentylthio)-2-furancarboxylic acid IUPAC Name: 5-pentylsulfanylfuran-2-carboxylic acid Traditional Name: 5-(amylthio)-2-furoic acid Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=CC=C(O1)C(=O)O

Isomeric SMILES

CCCCCSC1=CC=C(O1)C(=O)O

InChI

InChI=1S/C10H14O3S/c1-2-3-4-7-14-9-6-5-8(13-9)10(11)12/h5-6H,2-4,7H2,1H3,(H,11,12)