2-[[3-[(4-phenylbutoxysulfinylamino)methyl]-1-benzofuran-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[3-[(4-phenylbutoxysulfinylamino)methyl]-1-benzofuran-7-yl]oxy]ethanoic acid Openeye Name: 2-[3-[(4-phenylbutoxysulfinylamino)methyl]benzofuran-7-yl]oxyacetic acid CAS Name: 2-[[3-[(4-phenylbutoxysulfinylamino)methyl]-7-benzofuranyl]oxy]acetic acid IUPAC Name: 2-[[3-[(4-phenylbutoxysulfinylamino)methyl]-1-benzofuran-7-yl]oxy]acetic acid Traditional Name: 2-[3-[(4-phenylbutoxysulfinylamino)methyl]benzofuran-7-yl]oxyacetic acid Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO6S/c23-20(24)15-26-19-11-6-10-18-17(14-27-21(18)19)13-22-29(25)28-12-5-4-9-16-7-2-1-3-8-16/h1-3,6-8,10-11,14,22H,4-5,9,12-13,15H2,(H,23,24)