azane; 2-[2,3,6-tris(chloranyl)phenyl]ethanoic acid

Systemtic Name: azane; 2-[2,3,6-tris(chloranyl)phenyl]ethanoic acid Openeye Name: ammonia; 2-(2,3,6-trichlorophenyl)acetic acid CAS Name: ammonia; 2-(2,3,6-trichlorophenyl)acetic acid IUPAC Name: azane; 2-(2,3,6-trichlorophenyl)acetic acid Traditional Name: ammonia; 2-(2,3,6-trichlorophenyl)acetic acid Formula: C8H8Cl3NO2 MolecularWeight: 256.51362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1Cl)CC(=O)O)Cl)Cl.N

Isomeric SMILES

C1=CC(=C(C(=C1Cl)CC(=O)O)Cl)Cl.N

InChI

InChI=1S/C8H5Cl3O2.H3N/c9-5-1-2-6(10)8(11)4(5)3-7(12)13;/h1-2H,3H2,(H,12,13);1H3