2-[2-[(4-bromophenyl)methylsulfanyl]ethylamino]ethanoic acid

Systemtic Name: 2-[2-[(4-bromophenyl)methylsulfanyl]ethylamino]ethanoic acid Openeye Name: 2-[2-[(4-bromophenyl)methylsulfanyl]ethylamino]acetic acid CAS Name: 2-[2-[(4-bromophenyl)methylthio]ethylamino]acetic acid IUPAC Name: 2-[2-[(4-bromophenyl)methylsulfanyl]ethylamino]acetic acid Traditional Name: 2-[2-[(4-bromobenzyl)thio]ethylamino]acetic acid Formula: C11H14BrNO2S MolecularWeight: 304.20336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCNCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1CSCCNCC(=O)O)Br

InChI

InChI=1S/C11H14BrNO2S/c12-10-3-1-9(2-4-10)8-16-6-5-13-7-11(14)15/h1-4,13H,5-8H2,(H,14,15)