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

Systemtic Name: 4-(butylamino)-2,5,6-tris(chloranyl)pyridine-3-carboxylic acid Openeye Name: 4-(butylamino)-2,5,6-trichloro-pyridine-3-carboxylic acid CAS Name: 4-(butylamino)-2,5,6-trichloro-3-pyridinecarboxylic acid IUPAC Name: 4-(butylamino)-2,5,6-trichloropyridine-3-carboxylic acid Traditional Name: 4-(butylamino)-2,5,6-trichloro-nicotinic acid Formula: C10H11Cl3N2O2 MolecularWeight: 297.56554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC(=C1Cl)Cl)Cl)C(=O)O

Isomeric SMILES

CCCCNC1=C(C(=NC(=C1Cl)Cl)Cl)C(=O)O

InChI

InChI=1S/C10H11Cl3N2O2/c1-2-3-4-14-7-5(10(16)17)8(12)15-9(13)6(7)11/h2-4H2,1H3,(H,14,15)(H,16,17)