4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]butanoic acid CAS Name: 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]butyric acid Formula: C12H16BrNO5S MolecularWeight: 366.22814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NCCCC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NCCCC(=O)O

InChI

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