(6-chloranylpyridin-3-yl) 4-(4-butylphenyl)benzoate

Systemtic Name: (6-chloranylpyridin-3-yl) 4-(4-butylphenyl)benzoate Openeye Name: (6-chloro-3-pyridyl) 4-(4-butylphenyl)benzoate CAS Name: 4-(4-butylphenyl)benzoic acid (6-chloro-3-pyridinyl) ester IUPAC Name: (6-chloropyridin-3-yl) 4-(4-butylphenyl)benzoate Traditional Name: 4-(4-butylphenyl)benzoic acid (6-chloro-3-pyridyl) ester Formula: C22H20ClNO2 MolecularWeight: 365.8527

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CN=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CN=C(C=C3)Cl

InChI

InChI=1S/C22H20ClNO2/c1-2-3-4-16-5-7-17(8-6-16)18-9-11-19(12-10-18)22(25)26-20-13-14-21(23)24-15-20/h5-15H,2-4H2,1H3