2-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]ethanoic acid

Systemtic Name: 2-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]ethanoic acid Openeye Name: 2-[1-(5-bromo-2-hydroxy-phenyl)propylamino]acetic acid CAS Name: 2-[1-(5-bromo-2-hydroxyphenyl)propylamino]acetic acid IUPAC Name: 2-[1-(5-bromo-2-hydroxyphenyl)propylamino]acetic acid Traditional Name: 2-[1-(5-bromo-2-hydroxy-phenyl)propylamino]acetic acid Formula: C11H14BrNO3 MolecularWeight: 288.13776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)NCC(=O)O

Isomeric SMILES

CCC(C1=C(C=CC(=C1)Br)O)NCC(=O)O

InChI

InChI=1S/C11H14BrNO3/c1-2-9(13-6-11(15)16)8-5-7(12)3-4-10(8)14/h3-5,9,13-14H,2,6H2,1H3,(H,15,16)