5-(4-acetyloxybutyl)pyridine-2-carboxylic acid

Systemtic Name: 5-(4-acetyloxybutyl)pyridine-2-carboxylic acid Openeye Name: 5-(4-acetoxybutyl)pyridine-2-carboxylic acid CAS Name: 5-(4-acetyloxybutyl)-2-pyridinecarboxylic acid IUPAC Name: 5-(4-acetyloxybutyl)pyridine-2-carboxylic acid Traditional Name: 5-(4-acetoxybutyl)picolinic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCC1=CN=C(C=C1)C(=O)O

Isomeric SMILES

CC(=O)OCCCCC1=CN=C(C=C1)C(=O)O

InChI

InChI=1S/C12H15NO4/c1-9(14)17-7-3-2-4-10-5-6-11(12(15)16)13-8-10/h5-6,8H,2-4,7H2,1H3,(H,15,16)