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

Systemtic Name: 2-[[1-[[(4-ethylphenyl)sulfonylamino]methyl]-3,4-dihydro-1H-isochromen-6-yl]oxy]ethanoic acid Openeye Name: 2-[1-[[(4-ethylphenyl)sulfonylamino]methyl]isochroman-6-yl]oxyacetic acid CAS Name: 2-[[1-[[(4-ethylphenyl)sulfonylamino]methyl]-3,4-dihydro-1H-2-benzopyran-6-yl]oxy]acetic acid IUPAC Name: 2-[[1-[[(4-ethylphenyl)sulfonylamino]methyl]-3,4-dihydro-1H-isochromen-6-yl]oxy]acetic acid Traditional Name: 2-[1-[[(4-ethylphenyl)sulfonylamino]methyl]isochroman-6-yl]oxyacetic acid Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NCC2C3=C(CCO2)C=C(C=C3)OCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NCC2C3=C(CCO2)C=C(C=C3)OCC(=O)O

InChI

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