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

Systemtic Name: 3-[(3-bromanyl-5-chloranyl-2-methoxy-phenyl)sulfonylamino]butanoic acid Openeye Name: 3-[(3-bromo-5-chloro-2-methoxy-phenyl)sulfonylamino]butanoic acid CAS Name: 3-[(3-bromo-5-chloro-2-methoxyphenyl)sulfonylamino]butanoic acid IUPAC Name: 3-[(3-bromo-5-chloro-2-methoxyphenyl)sulfonylamino]butanoic acid Traditional Name: 3-[(3-bromo-5-chloro-2-methoxy-phenyl)sulfonylamino]butyric acid Formula: C11H13BrClNO5S MolecularWeight: 386.64662

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NS(=O)(=O)C1=CC(=CC(=C1OC)Br)Cl

Isomeric SMILES

CC(CC(=O)O)NS(=O)(=O)C1=CC(=CC(=C1OC)Br)Cl

InChI

InChI=1S/C11H13BrClNO5S/c1-6(3-10(15)16)14-20(17,18)9-5-7(13)4-8(12)11(9)19-2/h4-6,14H,3H2,1-2H3,(H,15,16)