4-[2-(2-methylbutyl)phenyl]-5-undecyl-pyridine-2-carboxylic acid

Systemtic Name: 4-[2-(2-methylbutyl)phenyl]-5-undecyl-pyridine-2-carboxylic acid Openeye Name: 4-[2-(2-methylbutyl)phenyl]-5-undecyl-pyridine-2-carboxylic acid CAS Name: 4-[2-(2-methylbutyl)phenyl]-5-undecyl-2-pyridinecarboxylic acid IUPAC Name: 4-[2-(2-methylbutyl)phenyl]-5-undecylpyridine-2-carboxylic acid Traditional Name: 4-[2-(2-methylbutyl)phenyl]-5-undecyl-picolinic acid Formula: C28H41NO2 MolecularWeight: 423.63064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(C=C1C2=CC=CC=C2CC(C)CC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(C=C1C2=CC=CC=C2CC(C)CC)C(=O)O

InChI

InChI=1S/C28H41NO2/c1-4-6-7-8-9-10-11-12-13-17-24-21-29-27(28(30)31)20-26(24)25-18-15-14-16-23(25)19-22(3)5-2/h14-16,18,20-22H,4-13,17,19H2,1-3H3,(H,30,31)