4-[(4-acetamido-2-fluoranyl-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(4-acetamido-2-fluoranyl-phenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(4-acetamido-2-fluoro-phenyl)sulfonylamino]butanoic acid CAS Name: 4-[(4-acetamido-2-fluorophenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(4-acetamido-2-fluorophenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(4-acetamido-2-fluoro-phenyl)sulfonylamino]butyric acid Formula: C12H15FN2O5S MolecularWeight: 318.321303

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)S(=O)(=O)NCCCC(=O)O)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)S(=O)(=O)NCCCC(=O)O)F

InChI

InChI=1S/C12H15FN2O5S/c1-8(16)15-9-4-5-11(10(13)7-9)21(19,20)14-6-2-3-12(17)18/h4-5,7,14H,2-3,6H2,1H3,(H,15,16)(H,17,18)