2-azanyl-3-[2-[2,6-bis(chloranyl)phenoxy]ethylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-[2,6-bis(chloranyl)phenoxy]ethylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[2-(2,6-dichlorophenoxy)ethylsulfanyl]propanoic acid CAS Name: 2-amino-3-[2-(2,6-dichlorophenoxy)ethylthio]propanoic acid IUPAC Name: 2-amino-3-[2-(2,6-dichlorophenoxy)ethylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[2-(2,6-dichlorophenoxy)ethylthio]propionic acid Formula: C11H13Cl2NO3S MolecularWeight: 310.19682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13Cl2NO3S/c12-7-2-1-3-8(13)10(7)17-4-5-18-6-9(14)11(15)16/h1-3,9H,4-6,14H2,(H,15,16)