2-[2-(3-bromanylphenoxy)ethanoylamino]butanoic acid

Systemtic Name: 2-[2-(3-bromanylphenoxy)ethanoylamino]butanoic acid Openeye Name: 2-[[2-(3-bromophenoxy)acetyl]amino]butanoic acid CAS Name: 2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]butanoic acid IUPAC Name: 2-[[2-(3-bromophenoxy)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(3-bromophenoxy)acetyl]amino]butyric acid Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)COC1=CC(=CC=C1)Br

Isomeric SMILES

CCC(C(=O)O)NC(=O)COC1=CC(=CC=C1)Br

InChI

InChI=1S/C12H14BrNO4/c1-2-10(12(16)17)14-11(15)7-18-9-5-3-4-8(13)6-9/h3-6,10H,2,7H2,1H3,(H,14,15)(H,16,17)