6-[4-(4-butoxyphenyl)phenyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[4-(4-butoxyphenyl)phenyl]pyridine-3-carboxylic acid Openeye Name: 6-[4-(4-butoxyphenyl)phenyl]pyridine-3-carboxylic acid CAS Name: 6-[4-(4-butoxyphenyl)phenyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[4-(4-butoxyphenyl)phenyl]pyridine-3-carboxylic acid Traditional Name: 6-[4-(4-butoxyphenyl)phenyl]nicotinic acid Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H21NO3/c1-2-3-14-26-20-11-8-17(9-12-20)16-4-6-18(7-5-16)21-13-10-19(15-23-21)22(24)25/h4-13,15H,2-3,14H2,1H3,(H,24,25)