3-[(5-chloranyl-2-cyano-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(5-chloranyl-2-cyano-phenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(5-chloro-2-cyano-phenyl)sulfonylamino]propanoic acid CAS Name: 3-[(5-chloro-2-cyanophenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(5-chloro-2-cyanophenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(5-chloro-2-cyano-phenyl)sulfonylamino]propionic acid Formula: C10H9ClN2O4S MolecularWeight: 288.70746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)S(=O)(=O)NCCC(=O)O)C#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)S(=O)(=O)NCCC(=O)O)C#N

InChI

InChI=1S/C10H9ClN2O4S/c11-8-2-1-7(6-12)9(5-8)18(16,17)13-4-3-10(14)15/h1-2,5,13H,3-4H2,(H,14,15)