2-[(5-carboxylato-2-methyl-furan-3-yl)methylsulfanylmethyl]-5-phenyl-furan-3-carboxylate

Systemtic Name: 2-[(5-carboxylato-2-methyl-furan-3-yl)methylsulfanylmethyl]-5-phenyl-furan-3-carboxylate Openeye Name: 2-[(5-carboxylato-2-methyl-3-furyl)methylsulfanylmethyl]-5-phenyl-furan-3-carboxylate CAS Name: 2-[[(5-carboxylato-2-methyl-3-furanyl)methylthio]methyl]-5-phenyl-3-furancarboxylate IUPAC Name: 2-[(5-carboxylato-2-methylfuran-3-yl)methylsulfanylmethyl]-5-phenylfuran-3-carboxylate Traditional Name: 2-[[(5-carboxylato-2-methyl-3-furyl)methylthio]methyl]-5-phenyl-3-furoate Formula: C19H14O6S-2 MolecularWeight: 370.37586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)[O-])CSCC2=C(C=C(O2)C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(O1)C(=O)[O-])CSCC2=C(C=C(O2)C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C19H16O6S/c1-11-13(7-16(24-11)19(22)23)9-26-10-17-14(18(20)21)8-15(25-17)12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,20,21)(H,22,23)/p-2