5-(ethylsulfanylmethyl)furan-2-carboxylate

Systemtic Name: 5-(ethylsulfanylmethyl)furan-2-carboxylate Openeye Name: 5-(ethylsulfanylmethyl)furan-2-carboxylate CAS Name: 5-[(ethylthio)methyl]-2-furancarboxylate IUPAC Name: 5-(ethylsulfanylmethyl)furan-2-carboxylate Traditional Name: 5-[(ethylthio)methyl]-2-furoate Formula: C8H9O3S- MolecularWeight: 185.22026

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=CC=C(O1)C(=O)[O-]

Isomeric SMILES

CCSCC1=CC=C(O1)C(=O)[O-]

InChI

InChI=1S/C8H10O3S/c1-2-12-5-6-3-4-7(11-6)8(9)10/h3-4H,2,5H2,1H3,(H,9,10)/p-1