2-(2-hydroxyethylsulfanylmethyl)-5-phenyl-furan-3-carboxylate

Systemtic Name: 2-(2-hydroxyethylsulfanylmethyl)-5-phenyl-furan-3-carboxylate Openeye Name: 2-(2-hydroxyethylsulfanylmethyl)-5-phenyl-furan-3-carboxylate CAS Name: 2-[(2-hydroxyethylthio)methyl]-5-phenyl-3-furancarboxylate IUPAC Name: 2-(2-hydroxyethylsulfanylmethyl)-5-phenylfuran-3-carboxylate Traditional Name: 2-[(2-hydroxyethylthio)methyl]-5-phenyl-3-furoate Formula: C14H13O4S- MolecularWeight: 277.31562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(O2)CSCCO)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(O2)CSCCO)C(=O)[O-]

InChI

InChI=1S/C14H14O4S/c15-6-7-19-9-13-11(14(16)17)8-12(18-13)10-4-2-1-3-5-10/h1-5,8,15H,6-7,9H2,(H,16,17)/p-1