2,4-bis(8-methylnonyl)pyridine-3,5-dicarboxylic acid

Systemtic Name: 2,4-bis(8-methylnonyl)pyridine-3,5-dicarboxylic acid Openeye Name: 2,4-bis(8-methylnonyl)pyridine-3,5-dicarboxylic acid CAS Name: 2,4-bis(8-methylnonyl)pyridine-3,5-dicarboxylic acid IUPAC Name: 2,4-bis(8-methylnonyl)pyridine-3,5-dicarboxylic acid Traditional Name: 2,4-bis(8-methylnonyl)dinicotinic acid Formula: C27H45NO4 MolecularWeight: 447.6505

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H45NO4/c1-20(2)15-11-7-5-9-13-17-22-23(26(29)30)19-28-24(25(22)27(31)32)18-14-10-6-8-12-16-21(3)4/h19-21H,5-18H2,1-4H3,(H,29,30)(H,31,32)