3-[3-(1-methylimidazol-2-yl)-2-(methylsulfonylamino)phenyl]propanoic acid

Systemtic Name: 3-[3-(1-methylimidazol-2-yl)-2-(methylsulfonylamino)phenyl]propanoic acid Openeye Name: 3-[2-(methanesulfonamido)-3-(1-methylimidazol-2-yl)phenyl]propanoic acid CAS Name: 3-[2-(methanesulfonamido)-3-(1-methyl-2-imidazolyl)phenyl]propanoic acid IUPAC Name: 3-[2-(methanesulfonamido)-3-(1-methylimidazol-2-yl)phenyl]propanoic acid Traditional Name: 3-[2-(methanesulfonamido)-3-(1-methylimidazol-2-yl)phenyl]propionic acid Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=C(C(=CC=C2)CCC(=O)O)NS(=O)(=O)C

Isomeric SMILES

CN1C=CN=C1C2=C(C(=CC=C2)CCC(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C14H17N3O4S/c1-17-9-8-15-14(17)11-5-3-4-10(6-7-12(18)19)13(11)16-22(2,20)21/h3-5,8-9,16H,6-7H2,1-2H3,(H,18,19)