5-chloranyl-6-(4-methylpentoxy)pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-(4-methylpentoxy)pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-isohexyloxy-pyridine-3-carboxylic acid CAS Name: 5-chloro-6-(4-methylpentoxy)-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-(4-methylpentoxy)pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-isohexyloxy-nicotinic acid Formula: C12H16ClNO3 MolecularWeight: 257.71334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=C(C=C(C=N1)C(=O)O)Cl

Isomeric SMILES

CC(C)CCCOC1=C(C=C(C=N1)C(=O)O)Cl

InChI

InChI=1S/C12H16ClNO3/c1-8(2)4-3-5-17-11-10(13)6-9(7-14-11)12(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)