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

Systemtic Name: N-methylmethanamine; 2-[2,3,6-tris(chloranyl)phenyl]ethanoic acid Openeye Name: N-methylmethanamine; 2-(2,3,6-trichlorophenyl)acetic acid CAS Name: N-methylmethanamine; 2-(2,3,6-trichlorophenyl)acetic acid IUPAC Name: N-methylmethanamine; 2-(2,3,6-trichlorophenyl)acetic acid Traditional Name: dimethylamine; 2-(2,3,6-trichlorophenyl)acetic acid Formula: C10H12Cl3NO2 MolecularWeight: 284.56678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H5Cl3O2.C2H7N/c9-5-1-2-6(10)8(11)4(5)3-7(12)13;1-3-2/h1-2H,3H2,(H,12,13);3H,1-2H3