2-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]butanoic acid CAS Name: 2-[(5-bromo-2-ethoxyphenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(5-bromo-2-ethoxyphenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]butyric acid Formula: C12H16BrNO5S MolecularWeight: 366.22814

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)Br)OCC

Isomeric SMILES

CCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)Br)OCC

InChI

InChI=1S/C12H16BrNO5S/c1-3-9(12(15)16)14-20(17,18)11-7-8(13)5-6-10(11)19-4-2/h5-7,9,14H,3-4H2,1-2H3,(H,15,16)