3-(furan-2-ylmethylsulfanylmethyl)benzoate

Systemtic Name: 3-(furan-2-ylmethylsulfanylmethyl)benzoate Openeye Name: 3-(2-furylmethylsulfanylmethyl)benzoate CAS Name: 3-[(2-furanylmethylthio)methyl]benzoate IUPAC Name: 3-(furan-2-ylmethylsulfanylmethyl)benzoate Traditional Name: 3-[(2-furfurylthio)methyl]benzoate Formula: C13H11O3S- MolecularWeight: 247.28964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSCC2=CC=CO2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)CSCC2=CC=CO2)C(=O)[O-]

InChI

InChI=1S/C13H12O3S/c14-13(15)11-4-1-3-10(7-11)8-17-9-12-5-2-6-16-12/h1-7H,8-9H2,(H,14,15)/p-1