2-[3-(3-bromanylpropylamino)phenyl]ethanoic acid

Systemtic Name: 2-[3-(3-bromanylpropylamino)phenyl]ethanoic acid Openeye Name: 2-[3-(3-bromopropylamino)phenyl]acetic acid CAS Name: 2-[3-(3-bromopropylamino)phenyl]acetic acid IUPAC Name: 2-[3-(3-bromopropylamino)phenyl]acetic acid Traditional Name: 2-[3-(3-bromopropylamino)phenyl]acetic acid Formula: C11H14BrNO2 MolecularWeight: 272.13836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCCCBr)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NCCCBr)CC(=O)O

InChI

InChI=1S/C11H14BrNO2/c12-5-2-6-13-10-4-1-3-9(7-10)8-11(14)15/h1,3-4,7,13H,2,5-6,8H2,(H,14,15)