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

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

Systemtic Name:4-heptyl-2,6-dimethyl-1H-pyridine-3,4-dicarboxylic acid
Openeye Name:4-heptyl-2,6-dimethyl-1H-pyridine-3,4-dicarboxylic acid
CAS Name:4-heptyl-2,6-dimethyl-1H-pyridine-3,4-dicarboxylic acid
IUPAC Name:4-heptyl-2,6-dimethyl-1H-pyridine-3,4-dicarboxylic acid
Traditional Name:4-heptyl-2,6-dimethyl-1H-pyridine-3,4-dicarboxylic acid
Formula: C16H25NO4
MolecularWeight: 295.374
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C=C(NC(=C1C(=O)O)C)C)C(=O)O


Isomeric SMILES

CCCCCCCC1(C=C(NC(=C1C(=O)O)C)C)C(=O)O


InChI

InChI=1S/C16H25NO4/c1-4-5-6-7-8-9-16(15(20)21)10-11(2)17-12(3)13(16)14(18)19/h10,17H,4-9H2,1-3H3,(H,18,19)(H,20,21)


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