6-[2-(3-bromanylphenoxy)ethanoylamino]hexanoic acid

Systemtic Name: 6-[2-(3-bromanylphenoxy)ethanoylamino]hexanoic acid Openeye Name: 6-[[2-(3-bromophenoxy)acetyl]amino]hexanoic acid CAS Name: 6-[[2-(3-bromophenoxy)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(3-bromophenoxy)acetyl]amino]hexanoic acid Traditional Name: 6-[[2-(3-bromophenoxy)acetyl]amino]hexanoic acid Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C14H18BrNO4/c15-11-5-4-6-12(9-11)20-10-13(17)16-8-3-1-2-7-14(18)19/h4-6,9H,1-3,7-8,10H2,(H,16,17)(H,18,19)