(E)-3-[3-(butylsulfamoyl)-4-methyl-phenyl]but-2-enoic acid

Systemtic Name: (E)-3-[3-(butylsulfamoyl)-4-methyl-phenyl]but-2-enoic acid Openeye Name: (E)-3-[3-(butylsulfamoyl)-4-methyl-phenyl]but-2-enoic acid CAS Name: (E)-3-[3-(butylsulfamoyl)-4-methylphenyl]-2-butenoic acid IUPAC Name: (E)-3-[3-(butylsulfamoyl)-4-methylphenyl]but-2-enoic acid Traditional Name: (E)-3-[3-(butylsulfamoyl)-4-methyl-phenyl]but-2-enoic acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=C(C=CC(=C1)C(=CC(=O)O)C)C

Isomeric SMILES

CCCCNS(=O)(=O)C1=C(C=CC(=C1)/C(=C/C(=O)O)/C)C

InChI

InChI=1S/C15H21NO4S/c1-4-5-8-16-21(19,20)14-10-13(7-6-11(14)2)12(3)9-15(17)18/h6-7,9-10,16H,4-5,8H2,1-3H3,(H,17,18)/b12-9+