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

Systemtic Name: (E)-3-[3,4-dimethoxy-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3,4-dimethoxy-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3,4-dimethoxy-5-[(4-methyl-3-sulfamoylphenyl)sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3,4-dimethoxy-5-[(4-methyl-3-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3,4-dimethoxy-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]phenyl]acrylic acid Formula: C18H20N2O8S2 MolecularWeight: 456.49

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2OC)OC)C=CC(=O)O)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2OC)OC)/C=C/C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C18H20N2O8S2/c1-11-4-6-13(10-15(11)29(19,23)24)20-30(25,26)16-9-12(5-7-17(21)22)8-14(27-2)18(16)28-3/h4-10,20H,1-3H3,(H,21,22)(H2,19,23,24)/b7-5+