3-[5-(4-propan-2-ylphenyl)pyridin-3-yl]benzoic acid

Systemtic Name: 3-[5-(4-propan-2-ylphenyl)pyridin-3-yl]benzoic acid Openeye Name: 3-[5-(4-isopropylphenyl)-3-pyridyl]benzoic acid CAS Name: 3-[5-(4-propan-2-ylphenyl)-3-pyridinyl]benzoic acid IUPAC Name: 3-[5-(4-propan-2-ylphenyl)pyridin-3-yl]benzoic acid Traditional Name: 3-(5-p-cumenyl-3-pyridyl)benzoic acid Formula: C21H19NO2 MolecularWeight: 317.38106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CC(=CN=C2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CC(=CN=C2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C21H19NO2/c1-14(2)15-6-8-16(9-7-15)19-11-20(13-22-12-19)17-4-3-5-18(10-17)21(23)24/h3-14H,1-2H3,(H,23,24)