3-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]propanoic acid

Systemtic Name: 3-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]propanoic acid Openeye Name: 3-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]propanoic acid CAS Name: 3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]propanoic acid IUPAC Name: 3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]propanoic acid Traditional Name: 3-[(3,5-dichloro-2-hydroxy-benzyl)amino]propionic acid Formula: C10H11Cl2NO3 MolecularWeight: 264.10524

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)O)CNCCC(=O)O)Cl

Isomeric SMILES

C1=C(C=C(C(=C1Cl)O)CNCCC(=O)O)Cl

InChI

InChI=1S/C10H11Cl2NO3/c11-7-3-6(10(16)8(12)4-7)5-13-2-1-9(14)15/h3-4,13,16H,1-2,5H2,(H,14,15)