3-butyl-2-phenyl-pyridine-4-carboxylic acid

Systemtic Name: 3-butyl-2-phenyl-pyridine-4-carboxylic acid Openeye Name: 3-butyl-2-phenyl-pyridine-4-carboxylic acid CAS Name: 3-butyl-2-phenyl-4-pyridinecarboxylic acid IUPAC Name: 3-butyl-2-phenylpyridine-4-carboxylic acid Traditional Name: 3-butyl-2-phenyl-isonicotinic acid Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CN=C1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCC1=C(C=CN=C1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO2/c1-2-3-9-13-14(16(18)19)10-11-17-15(13)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3,(H,18,19)