(2-fluoranylpyridin-3-yl) 4-(4-butylphenyl)-2-chloranyl-benzoate

Systemtic Name: (2-fluoranylpyridin-3-yl) 4-(4-butylphenyl)-2-chloranyl-benzoate Openeye Name: (2-fluoro-3-pyridyl) 4-(4-butylphenyl)-2-chloro-benzoate CAS Name: 4-(4-butylphenyl)-2-chlorobenzoic acid (2-fluoro-3-pyridinyl) ester IUPAC Name: (2-fluoropyridin-3-yl) 4-(4-butylphenyl)-2-chlorobenzoate Traditional Name: 4-(4-butylphenyl)-2-chloro-benzoic acid (2-fluoro-3-pyridyl) ester Formula: C22H19ClFNO2 MolecularWeight: 383.843163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClFNO2/c1-2-3-5-15-7-9-16(10-8-15)17-11-12-18(19(23)14-17)22(26)27-20-6-4-13-25-21(20)24/h4,6-14H,2-3,5H2,1H3