2-(4-methylpentoxy)pyridine-3-carboxylic acid

Systemtic Name: 2-(4-methylpentoxy)pyridine-3-carboxylic acid Openeye Name: 2-isohexyloxypyridine-3-carboxylic acid CAS Name: 2-(4-methylpentoxy)-3-pyridinecarboxylic acid IUPAC Name: 2-(4-methylpentoxy)pyridine-3-carboxylic acid Traditional Name: 2-isohexyloxynicotinic acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3/c1-9(2)5-4-8-16-11-10(12(14)15)6-3-7-13-11/h3,6-7,9H,4-5,8H2,1-2H3,(H,14,15)