3-[2-(3-bromanylphenoxy)propanoylamino]propanoate

Systemtic Name: 3-[2-(3-bromanylphenoxy)propanoylamino]propanoate Openeye Name: 3-[2-(3-bromophenoxy)propanoylamino]propanoate CAS Name: 3-[[2-(3-bromophenoxy)-1-oxopropyl]amino]propanoate IUPAC Name: 3-[2-(3-bromophenoxy)propanoylamino]propanoate Traditional Name: 3-[2-(3-bromophenoxy)propanoylamino]propionate Formula: C12H13BrNO4- MolecularWeight: 315.13992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC(=O)[O-])OC1=CC(=CC=C1)Br

Isomeric SMILES

CC(C(=O)NCCC(=O)[O-])OC1=CC(=CC=C1)Br

InChI

InChI=1S/C12H14BrNO4/c1-8(12(17)14-6-5-11(15)16)18-10-4-2-3-9(13)7-10/h2-4,7-8H,5-6H2,1H3,(H,14,17)(H,15,16)/p-1