2-azanyl-3-[2-(3-bromanylphenoxy)ethylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(3-bromanylphenoxy)ethylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[2-(3-bromophenoxy)ethylsulfanyl]propanoic acid CAS Name: 2-amino-3-[2-(3-bromophenoxy)ethylthio]propanoic acid IUPAC Name: 2-amino-3-[2-(3-bromophenoxy)ethylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[2-(3-bromophenoxy)ethylthio]propionic acid Formula: C11H14BrNO3S MolecularWeight: 320.20276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCCSCC(C(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCCSCC(C(=O)O)N

InChI

InChI=1S/C11H14BrNO3S/c12-8-2-1-3-9(6-8)16-4-5-17-7-10(13)11(14)15/h1-3,6,10H,4-5,7,13H2,(H,14,15)