3-[[3-(2-chloranylphenoxy)-2-oxidanyl-propyl]amino]propanoic acid

Systemtic Name: 3-[[3-(2-chloranylphenoxy)-2-oxidanyl-propyl]amino]propanoic acid Openeye Name: 3-[[3-(2-chlorophenoxy)-2-hydroxy-propyl]amino]propanoic acid CAS Name: 3-[[3-(2-chlorophenoxy)-2-hydroxypropyl]amino]propanoic acid IUPAC Name: 3-[[3-(2-chlorophenoxy)-2-hydroxypropyl]amino]propanoic acid Traditional Name: 3-[[3-(2-chlorophenoxy)-2-hydroxy-propyl]amino]propionic acid Formula: C12H16ClNO4 MolecularWeight: 273.71274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC(CNCCC(=O)O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OCC(CNCCC(=O)O)O)Cl

InChI

InChI=1S/C12H16ClNO4/c13-10-3-1-2-4-11(10)18-8-9(15)7-14-6-5-12(16)17/h1-4,9,14-15H,5-8H2,(H,16,17)