4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylic acid hydrate

Systemtic Name: 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylic acid hydrate Openeye Name: 4-amino-3,5,6-trichloro-pyridine-2-carboxylic acid hydrate CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylic acid hydrate IUPAC Name: 4-amino-3,5,6-trichloropyridine-2-carboxylic acid hydrate Traditional Name: 4-amino-3,5,6-trichloro-picolinic acid hydrate Formula: C6H5Cl3N2O3 MolecularWeight: 259.4745

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H3Cl3N2O2.H2O/c7-1-3(10)2(8)5(9)11-4(1)6(12)13;/h(H2,10,11)(H,12,13);1H2