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

Systemtic Name: 4-[2-(2-methylbutyl)phenyl]-5-octyl-pyridine-2-carboxylic acid Openeye Name: 4-[2-(2-methylbutyl)phenyl]-5-octyl-pyridine-2-carboxylic acid CAS Name: 4-[2-(2-methylbutyl)phenyl]-5-octyl-2-pyridinecarboxylic acid IUPAC Name: 4-[2-(2-methylbutyl)phenyl]-5-octylpyridine-2-carboxylic acid Traditional Name: 4-[2-(2-methylbutyl)phenyl]-5-octyl-picolinic acid Formula: C25H35NO2 MolecularWeight: 381.5509

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1C2=CC=CC=C2CC(C)CC)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1C2=CC=CC=C2CC(C)CC)C(=O)O

InChI

InChI=1S/C25H35NO2/c1-4-6-7-8-9-10-14-21-18-26-24(25(27)28)17-23(21)22-15-12-11-13-20(22)16-19(3)5-2/h11-13,15,17-19H,4-10,14,16H2,1-3H3,(H,27,28)