5-octylpyridine-2,3-dicarboxylic acid

Systemtic Name: 5-octylpyridine-2,3-dicarboxylic acid Openeye Name: 5-octylpyridine-2,3-dicarboxylic acid CAS Name: 5-octylpyridine-2,3-dicarboxylic acid IUPAC Name: 5-octylpyridine-2,3-dicarboxylic acid Traditional Name: 5-octylquinolinic acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CN=C(C(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C15H21NO4/c1-2-3-4-5-6-7-8-11-9-12(14(17)18)13(15(19)20)16-10-11/h9-10H,2-8H2,1H3,(H,17,18)(H,19,20)