3-[4-methoxy-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: 3-[4-methoxy-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]phenyl]prop-2-enoic acid Openeye Name: 3-[4-methoxy-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]phenyl]prop-2-enoic acid CAS Name: 3-[4-methoxy-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]phenyl]-2-propenoic acid IUPAC Name: 3-[4-methoxy-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]phenyl]prop-2-enoic acid Traditional Name: 3-[4-methoxy-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]phenyl]acrylic acid Formula: C18H20N2O7S2 MolecularWeight: 440.4906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H20N2O7S2/c1-27-16-8-4-14(5-9-18(21)22)12-17(16)29(25,26)20-11-10-13-2-6-15(7-3-13)28(19,23)24/h2-9,12,20H,10-11H2,1H3,(H,21,22)(H2,19,23,24)