7-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]heptanoic acid

Systemtic Name: 7-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]heptanoic acid Openeye Name: 7-[(4-bromo-2-chloro-phenyl)sulfonylamino]heptanoic acid CAS Name: 7-[(4-bromo-2-chlorophenyl)sulfonylamino]heptanoic acid IUPAC Name: 7-[(4-bromo-2-chlorophenyl)sulfonylamino]heptanoic acid Traditional Name: 7-[(4-bromo-2-chloro-phenyl)sulfonylamino]enanthic acid Formula: C13H17BrClNO4S MolecularWeight: 398.70038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)S(=O)(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)S(=O)(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C13H17BrClNO4S/c14-10-6-7-12(11(15)9-10)21(19,20)16-8-4-2-1-3-5-13(17)18/h6-7,9,16H,1-5,8H2,(H,17,18)