2-(2-chlorophenyl)-6-heptyl-pyridine-3-carboxylic acid

Systemtic Name: 2-(2-chlorophenyl)-6-heptyl-pyridine-3-carboxylic acid Openeye Name: 2-(2-chlorophenyl)-6-heptyl-pyridine-3-carboxylic acid CAS Name: 2-(2-chlorophenyl)-6-heptyl-3-pyridinecarboxylic acid IUPAC Name: 2-(2-chlorophenyl)-6-heptylpyridine-3-carboxylic acid Traditional Name: 2-(2-chlorophenyl)-6-heptyl-nicotinic acid Formula: C19H22ClNO2 MolecularWeight: 331.83648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC(=C(C=C1)C(=O)O)C2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCC1=NC(=C(C=C1)C(=O)O)C2=CC=CC=C2Cl

InChI

InChI=1S/C19H22ClNO2/c1-2-3-4-5-6-9-14-12-13-16(19(22)23)18(21-14)15-10-7-8-11-17(15)20/h7-8,10-13H,2-6,9H2,1H3,(H,22,23)