2,6-dimethyl-4-pentyl-1H-pyridine-3,4-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-4-pentyl-1H-pyridine-3,4-dicarboxylic acid Openeye Name: 2,6-dimethyl-4-pentyl-1H-pyridine-3,4-dicarboxylic acid CAS Name: 2,6-dimethyl-4-pentyl-1H-pyridine-3,4-dicarboxylic acid IUPAC Name: 2,6-dimethyl-4-pentyl-1H-pyridine-3,4-dicarboxylic acid Traditional Name: 4-amyl-2,6-dimethyl-1H-pyridine-3,4-dicarboxylic acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C=C(NC(=C1C(=O)O)C)C)C(=O)O

Isomeric SMILES

CCCCCC1(C=C(NC(=C1C(=O)O)C)C)C(=O)O

InChI

InChI=1S/C14H21NO4/c1-4-5-6-7-14(13(18)19)8-9(2)15-10(3)11(14)12(16)17/h8,15H,4-7H2,1-3H3,(H,16,17)(H,18,19)