(E)-3-[3,4-dimethoxy-5-(pyridin-4-ylmethylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: (E)-3-[3,4-dimethoxy-5-(pyridin-4-ylmethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (E)-3-[3,4-dimethoxy-5-(4-pyridylmethylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3,4-dimethoxy-5-(pyridin-4-ylmethylsulfamoyl)phenyl]-2-propenoate IUPAC Name: (E)-3-[3,4-dimethoxy-5-(pyridin-4-ylmethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3,4-dimethoxy-5-(4-pyridylmethylsulfamoyl)phenyl]acrylate Formula: C17H17N2O6S- MolecularWeight: 377.39168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)[O-])S(=O)(=O)NCC2=CC=NC=C2)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)[O-])S(=O)(=O)NCC2=CC=NC=C2)OC

InChI

InChI=1S/C17H18N2O6S/c1-24-14-9-13(3-4-16(20)21)10-15(17(14)25-2)26(22,23)19-11-12-5-7-18-8-6-12/h3-10,19H,11H2,1-2H3,(H,20,21)/p-1/b4-3+