3,4-dipropylpyridine-2,5-dicarboxylic acid

Systemtic Name: 3,4-dipropylpyridine-2,5-dicarboxylic acid Openeye Name: 3,4-dipropylpyridine-2,5-dicarboxylic acid CAS Name: 3,4-dipropylpyridine-2,5-dicarboxylic acid IUPAC Name: 3,4-dipropylpyridine-2,5-dicarboxylic acid Traditional Name: 3,4-dipropylisocinchomeronic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC=C1C(=O)O)C(=O)O)CCC

Isomeric SMILES

CCCC1=C(C(=NC=C1C(=O)O)C(=O)O)CCC

InChI

InChI=1S/C13H17NO4/c1-3-5-8-9(6-4-2)11(13(17)18)14-7-10(8)12(15)16/h7H,3-6H2,1-2H3,(H,15,16)(H,17,18)