2-[[3-[(5-phenylpentoxysulfinylamino)methyl]-1-benzofuran-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[3-[(5-phenylpentoxysulfinylamino)methyl]-1-benzofuran-7-yl]oxy]ethanoic acid Openeye Name: 2-[3-[(5-phenylpentoxysulfinylamino)methyl]benzofuran-7-yl]oxyacetic acid CAS Name: 2-[[3-[(5-phenylpentoxysulfinylamino)methyl]-7-benzofuranyl]oxy]acetic acid IUPAC Name: 2-[[3-[(5-phenylpentoxysulfinylamino)methyl]-1-benzofuran-7-yl]oxy]acetic acid Traditional Name: 2-[3-[(5-phenylpentoxysulfinylamino)methyl]benzofuran-7-yl]oxyacetic acid Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCOS(=O)NCC2=COC3=C2C=CC=C3OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCOS(=O)NCC2=COC3=C2C=CC=C3OCC(=O)O

InChI

InChI=1S/C22H25NO6S/c24-21(25)16-27-20-12-7-11-19-18(15-28-22(19)20)14-23-30(26)29-13-6-2-5-10-17-8-3-1-4-9-17/h1,3-4,7-9,11-12,15,23H,2,5-6,10,13-14,16H2,(H,24,25)