2-[[1-(phenylsulfonylaminomethyl)-3,4-dihydro-1H-isochromen-6-yl]oxy]ethanoic acid

Systemtic Name: 2-[[1-(phenylsulfonylaminomethyl)-3,4-dihydro-1H-isochromen-6-yl]oxy]ethanoic acid Openeye Name: 2-[1-(benzenesulfonamidomethyl)isochroman-6-yl]oxyacetic acid CAS Name: 2-[[1-(benzenesulfonamidomethyl)-3,4-dihydro-1H-2-benzopyran-6-yl]oxy]acetic acid IUPAC Name: 2-[[1-(benzenesulfonamidomethyl)-3,4-dihydro-1H-isochromen-6-yl]oxy]acetic acid Traditional Name: 2-[1-(benzenesulfonamidomethyl)isochroman-6-yl]oxyacetic acid Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=C1C=C(C=C2)OCC(=O)O)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1COC(C2=C1C=C(C=C2)OCC(=O)O)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO6S/c20-18(21)12-25-14-6-7-16-13(10-14)8-9-24-17(16)11-19-26(22,23)15-4-2-1-3-5-15/h1-7,10,17,19H,8-9,11-12H2,(H,20,21)