(E)-6-(furan-2-ylmethylsulfanyl)-5-oxidanyl-9-phenyl-non-7-enoic acid

Systemtic Name: (E)-6-(furan-2-ylmethylsulfanyl)-5-oxidanyl-9-phenyl-non-7-enoic acid Openeye Name: (E)-6-(2-furylmethylsulfanyl)-5-hydroxy-9-phenyl-non-7-enoic acid CAS Name: (E)-6-(2-furanylmethylthio)-5-hydroxy-9-phenyl-7-nonenoic acid IUPAC Name: (E)-6-(furan-2-ylmethylsulfanyl)-5-hydroxy-9-phenylnon-7-enoic acid Traditional Name: (E)-6-(2-furfurylthio)-5-hydroxy-9-phenyl-non-7-enoic acid Formula: C20H24O4S MolecularWeight: 360.46716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC=CC(C(CCCC(=O)O)O)SCC2=CC=CO2

Isomeric SMILES

C1=CC=C(C=C1)C/C=C/C(C(CCCC(=O)O)O)SCC2=CC=CO2

InChI

InChI=1S/C20H24O4S/c21-18(11-5-13-20(22)23)19(25-15-17-10-6-14-24-17)12-4-9-16-7-2-1-3-8-16/h1-4,6-8,10,12,14,18-19,21H,5,9,11,13,15H2,(H,22,23)/b12-4+