2-[[2,2-dimethyl-4-(phenylsulfonylaminomethyl)-3,4-dihydrochromen-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[2,2-dimethyl-4-(phenylsulfonylaminomethyl)-3,4-dihydrochromen-7-yl]oxy]ethanoic acid Openeye Name: 2-[4-(benzenesulfonamidomethyl)-2,2-dimethyl-chroman-7-yl]oxyacetic acid CAS Name: 2-[[4-(benzenesulfonamidomethyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-7-yl]oxy]acetic acid IUPAC Name: 2-[[4-(benzenesulfonamidomethyl)-2,2-dimethyl-3,4-dihydrochromen-7-yl]oxy]acetic acid Traditional Name: 2-[4-(benzenesulfonamidomethyl)-2,2-dimethyl-chroman-7-yl]oxyacetic acid Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=C(C=C2)OCC(=O)O)CNS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=C(C=C2)OCC(=O)O)CNS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H23NO6S/c1-20(2)11-14(12-21-28(24,25)16-6-4-3-5-7-16)17-9-8-15(10-18(17)27-20)26-13-19(22)23/h3-10,14,21H,11-13H2,1-2H3,(H,22,23)