2-[[1-[(quinolin-8-ylsulfonylamino)methyl]-3,4-dihydro-1H-isochromen-6-yl]oxy]ethanoic acid

Systemtic Name: 2-[[1-[(quinolin-8-ylsulfonylamino)methyl]-3,4-dihydro-1H-isochromen-6-yl]oxy]ethanoic acid Openeye Name: 2-[1-[(8-quinolylsulfonylamino)methyl]isochroman-6-yl]oxyacetic acid CAS Name: 2-[[1-[(8-quinolinylsulfonylamino)methyl]-3,4-dihydro-1H-2-benzopyran-6-yl]oxy]acetic acid IUPAC Name: 2-[[1-[(quinolin-8-ylsulfonylamino)methyl]-3,4-dihydro-1H-isochromen-6-yl]oxy]acetic acid Traditional Name: 2-[1-[(8-quinolylsulfonylamino)methyl]isochroman-6-yl]oxyacetic acid Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=C1C=C(C=C2)OCC(=O)O)CNS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1COC(C2=C1C=C(C=C2)OCC(=O)O)CNS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H20N2O6S/c24-20(25)13-29-16-6-7-17-15(11-16)8-10-28-18(17)12-23-30(26,27)19-5-1-3-14-4-2-9-22-21(14)19/h1-7,9,11,18,23H,8,10,12-13H2,(H,24,25)