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

Systemtic Name: (E)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-pyrimidylsulfamoyl)phenyl]acrylic acid Formula: C13H11N3O4S MolecularWeight: 305.30914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C13H11N3O4S/c17-12(18)7-4-10-2-5-11(6-3-10)21(19,20)16-13-14-8-1-9-15-13/h1-9H,(H,17,18)(H,14,15,16)/b7-4+