3-(furan-2-ylmethylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name: 3-(furan-2-ylmethylsulfanylmethyl)-1-benzofuran-2-carboxylate Openeye Name: 3-(2-furylmethylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(2-furanylmethylthio)methyl]-2-benzofurancarboxylate IUPAC Name: 3-(furan-2-ylmethylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(2-furfurylthio)methyl]coumarilate Formula: C15H11O4S- MolecularWeight: 287.31044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C(=O)[O-])CSCC3=CC=CO3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C(=O)[O-])CSCC3=CC=CO3

InChI

InChI=1S/C15H12O4S/c16-15(17)14-12(9-20-8-10-4-3-7-18-10)11-5-1-2-6-13(11)19-14/h1-7H,8-9H2,(H,16,17)/p-1