4-(5-butylpyridin-2-yl)benzoic acid

Systemtic Name: 4-(5-butylpyridin-2-yl)benzoic acid Openeye Name: 4-(5-butyl-2-pyridyl)benzoic acid CAS Name: 4-(5-butyl-2-pyridinyl)benzoic acid IUPAC Name: 4-(5-butylpyridin-2-yl)benzoic acid Traditional Name: 4-(5-butyl-2-pyridyl)benzoic acid Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H17NO2/c1-2-3-4-12-5-10-15(17-11-12)13-6-8-14(9-7-13)16(18)19/h5-11H,2-4H2,1H3,(H,18,19)