(E)-3-[4-methoxy-3-(pyridin-1-ium-3-ylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-methoxy-3-(pyridin-1-ium-3-ylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (E)-3-[4-methoxy-3-(pyridin-1-ium-3-ylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(3-pyridin-1-iumylsulfamoyl)phenyl]-2-propenoate IUPAC Name: (E)-3-[4-methoxy-3-(pyridin-1-ium-3-ylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-methoxy-3-(pyridin-1-ium-3-ylsulfamoyl)phenyl]acrylate Formula: C15H14N2O5S MolecularWeight: 334.34706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)[O-])S(=O)(=O)NC2=C[NH+]=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)[O-])S(=O)(=O)NC2=C[NH+]=CC=C2

InChI

InChI=1S/C15H14N2O5S/c1-22-13-6-4-11(5-7-15(18)19)9-14(13)23(20,21)17-12-3-2-8-16-10-12/h2-10,17H,1H3,(H,18,19)/b7-5+