4-[2-(4-bromanylphenoxy)ethanoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[2-(4-bromanylphenoxy)ethanoyl-methyl-amino]butanoic acid Openeye Name: 4-[[2-(4-bromophenoxy)acetyl]-methyl-amino]butanoic acid CAS Name: 4-[[2-(4-bromophenoxy)-1-oxoethyl]-methylamino]butanoic acid IUPAC Name: 4-[[2-(4-bromophenoxy)acetyl]-methylamino]butanoic acid Traditional Name: 4-[[2-(4-bromophenoxy)acetyl]-methyl-amino]butyric acid Formula: C13H16BrNO4 MolecularWeight: 330.17444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)COC1=CC=C(C=C1)Br

Isomeric SMILES

CN(CCCC(=O)O)C(=O)COC1=CC=C(C=C1)Br

InChI

InChI=1S/C13H16BrNO4/c1-15(8-2-3-13(17)18)12(16)9-19-11-6-4-10(14)5-7-11/h4-7H,2-3,8-9H2,1H3,(H,17,18)