2-[[3-[3-(diphenylmethyl)sulfanylpropyl]-1-benzofuran-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[3-[3-(diphenylmethyl)sulfanylpropyl]-1-benzofuran-7-yl]oxy]ethanoic acid Openeye Name: 2-[3-(3-benzhydrylsulfanylpropyl)benzofuran-7-yl]oxyacetic acid CAS Name: 2-[[3-[3-[(diphenylmethyl)thio]propyl]-7-benzofuranyl]oxy]acetic acid IUPAC Name: 2-[[3-(3-benzhydrylsulfanylpropyl)-1-benzofuran-7-yl]oxy]acetic acid Traditional Name: 2-[3-[3-(benzhydrylthio)propyl]benzofuran-7-yl]oxyacetic acid Formula: C26H24O4S MolecularWeight: 432.53136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCCCC3=COC4=C3C=CC=C4OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCCCC3=COC4=C3C=CC=C4OCC(=O)O

InChI

InChI=1S/C26H24O4S/c27-24(28)18-29-23-15-7-14-22-21(17-30-25(22)23)13-8-16-31-26(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-7,9-12,14-15,17,26H,8,13,16,18H2,(H,27,28)