(E)-3-[4-[3-(dimethylazaniumyl)propylsulfamoyl]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-[3-(dimethylazaniumyl)propylsulfamoyl]phenyl]prop-2-enoate Openeye Name: (E)-3-[4-[3-(dimethylammonio)propylsulfamoyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[3-(dimethylammonio)propylsulfamoyl]phenyl]-2-propenoate IUPAC Name: (E)-3-[4-[3-(dimethylazaniumyl)propylsulfamoyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[3-(dimethylammonio)propylsulfamoyl]phenyl]acrylate Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)[O-]

InChI

InChI=1S/C14H20N2O4S/c1-16(2)11-3-10-15-21(19,20)13-7-4-12(5-8-13)6-9-14(17)18/h4-9,15H,3,10-11H2,1-2H3,(H,17,18)/b9-6+