3-[4-(4-bromanylphenoxy)butanoylamino]propanoic acid

Systemtic Name: 3-[4-(4-bromanylphenoxy)butanoylamino]propanoic acid Openeye Name: 3-[4-(4-bromophenoxy)butanoylamino]propanoic acid CAS Name: 3-[[4-(4-bromophenoxy)-1-oxobutyl]amino]propanoic acid IUPAC Name: 3-[4-(4-bromophenoxy)butanoylamino]propanoic acid Traditional Name: 3-[4-(4-bromophenoxy)butanoylamino]propionic acid Formula: C13H16BrNO4 MolecularWeight: 330.17444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCC(=O)NCCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1OCCCC(=O)NCCC(=O)O)Br

InChI

InChI=1S/C13H16BrNO4/c14-10-3-5-11(6-4-10)19-9-1-2-12(16)15-8-7-13(17)18/h3-6H,1-2,7-9H2,(H,15,16)(H,17,18)