(E)-3-[3-[(furan-2-ylcarbonylamino)sulfamoyl]-4,5-dimethoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-[(furan-2-ylcarbonylamino)sulfamoyl]-4,5-dimethoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-[(furan-2-carbonylamino)sulfamoyl]-4,5-dimethoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[[[2-furanyl(oxo)methyl]amino]sulfamoyl]-4,5-dimethoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-[(furan-2-carbonylamino)sulfamoyl]-4,5-dimethoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-[(2-furoylamino)sulfamoyl]-4,5-dimethoxy-phenyl]acrylic acid Formula: C16H16N2O8S MolecularWeight: 396.37184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)O)S(=O)(=O)NNC(=O)C2=CC=CO2)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)O)S(=O)(=O)NNC(=O)C2=CC=CO2)OC

InChI

InChI=1S/C16H16N2O8S/c1-24-12-8-10(5-6-14(19)20)9-13(15(12)25-2)27(22,23)18-17-16(21)11-4-3-7-26-11/h3-9,18H,1-2H3,(H,17,21)(H,19,20)/b6-5+