(E)-3-[4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)sulfamoyl]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)sulfamoyl]phenyl]prop-2-enoate Openeye Name: (E)-3-[4-[(6-morpholinopyridin-1-ium-3-yl)sulfamoyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]sulfamoyl]phenyl]-2-propenoate IUPAC Name: (E)-3-[4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)sulfamoyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(6-morpholinopyridin-1-ium-3-yl)sulfamoyl]phenyl]acrylate Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C=CC(=O)[O-]

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)/C=C/C(=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c22-18(23)8-3-14-1-5-16(6-2-14)27(24,25)20-15-4-7-17(19-13-15)21-9-11-26-12-10-21/h1-8,13,20H,9-12H2,(H,22,23)/b8-3+