4-[2-(3-bromanylphenoxy)ethylamino]butanoic acid

Systemtic Name: 4-[2-(3-bromanylphenoxy)ethylamino]butanoic acid Openeye Name: 4-[2-(3-bromophenoxy)ethylamino]butanoic acid CAS Name: 4-[2-(3-bromophenoxy)ethylamino]butanoic acid IUPAC Name: 4-[2-(3-bromophenoxy)ethylamino]butanoic acid Traditional Name: 4-[2-(3-bromophenoxy)ethylamino]butyric acid Formula: C12H16BrNO3 MolecularWeight: 302.16434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCCNCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCCNCCCC(=O)O

InChI

InChI=1S/C12H16BrNO3/c13-10-3-1-4-11(9-10)17-8-7-14-6-2-5-12(15)16/h1,3-4,9,14H,2,5-8H2,(H,15,16)