(E)-3-[4-(2-acetamidoethylsulfamoyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-acetamidoethylsulfamoyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-acetamidoethylsulfamoyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-acetamidoethylsulfamoyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-acetamidoethylsulfamoyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-acetamidoethylsulfamoyl)phenyl]acrylic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

CC(=O)NCCNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)O

InChI

InChI=1S/C13H16N2O5S/c1-10(16)14-8-9-15-21(19,20)12-5-2-11(3-6-12)4-7-13(17)18/h2-7,15H,8-9H2,1H3,(H,14,16)(H,17,18)/b7-4+