2-azanyl-3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[2-(2-bromo-4-chloro-phenoxy)ethylsulfanyl]propanoic acid CAS Name: 2-amino-3-[2-(2-bromo-4-chlorophenoxy)ethylthio]propanoic acid IUPAC Name: 2-amino-3-[2-(2-bromo-4-chlorophenoxy)ethylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[2-(2-bromo-4-chloro-phenoxy)ethylthio]propionic acid Formula: C11H13BrClNO3S MolecularWeight: 354.64782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Br)OCCSCC(C(=O)O)N

Isomeric SMILES

C1=CC(=C(C=C1Cl)Br)OCCSCC(C(=O)O)N

InChI

InChI=1S/C11H13BrClNO3S/c12-8-5-7(13)1-2-10(8)17-3-4-18-6-9(14)11(15)16/h1-2,5,9H,3-4,6,14H2,(H,15,16)