(E)-3-[3-[(2-aminocarbonylphenyl)-methyl-sulfamoyl]-4-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-[(2-aminocarbonylphenyl)-methyl-sulfamoyl]-4-methoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-[(2-carbamoylphenyl)-methyl-sulfamoyl]-4-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[(2-carbamoylphenyl)-methylsulfamoyl]-4-methoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-[(2-carbamoylphenyl)-methylsulfamoyl]-4-methoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-[(2-carbamoylphenyl)-methyl-sulfamoyl]-4-methoxy-phenyl]acrylic acid Formula: C18H18N2O6S MolecularWeight: 390.41032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)N)S(=O)(=O)C2=C(C=CC(=C2)C=CC(=O)O)OC

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)N)S(=O)(=O)C2=C(C=CC(=C2)/C=C/C(=O)O)OC

InChI

InChI=1S/C18H18N2O6S/c1-20(14-6-4-3-5-13(14)18(19)23)27(24,25)16-11-12(8-10-17(21)22)7-9-15(16)26-2/h3-11H,1-2H3,(H2,19,23)(H,21,22)/b10-8+