2-[[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]phenyl]sulfonylamino]acetic acid Formula: C18H18N2O8S MolecularWeight: 422.40912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC(=O)O

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C18H18N2O8S/c1-26-14-8-11(9-15-17(14)28-7-6-27-15)18(23)20-12-2-4-13(5-3-12)29(24,25)19-10-16(21)22/h2-5,8-9,19H,6-7,10H2,1H3,(H,20,23)(H,21,22)