3-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 3-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]butanoic acid Openeye Name: 3-[(5-bromo-2-methoxy-phenyl)sulfonylamino]butanoic acid CAS Name: 3-[(5-bromo-2-methoxyphenyl)sulfonylamino]butanoic acid IUPAC Name: 3-[(5-bromo-2-methoxyphenyl)sulfonylamino]butanoic acid Traditional Name: 3-[(5-bromo-2-methoxy-phenyl)sulfonylamino]butyric acid Formula: C11H14BrNO5S MolecularWeight: 352.20156

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CC(CC(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C11H14BrNO5S/c1-7(5-11(14)15)13-19(16,17)10-6-8(12)3-4-9(10)18-2/h3-4,6-7,13H,5H2,1-2H3,(H,14,15)