5-chloranyl-6-(pentan-2-ylamino)pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-(pentan-2-ylamino)pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-(1-methylbutylamino)pyridine-3-carboxylic acid CAS Name: 5-chloro-6-(pentan-2-ylamino)-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-(pentan-2-ylamino)pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-(1-methylbutylamino)nicotinic acid Formula: C11H15ClN2O2 MolecularWeight: 242.702

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC1=C(C=C(C=N1)C(=O)O)Cl

Isomeric SMILES

CCCC(C)NC1=C(C=C(C=N1)C(=O)O)Cl

InChI

InChI=1S/C11H15ClN2O2/c1-3-4-7(2)14-10-9(12)5-8(6-13-10)11(15)16/h5-7H,3-4H2,1-2H3,(H,13,14)(H,15,16)