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

Systemtic Name: (2-fluoranylpyridin-3-yl) 2-chloranyl-4-(4-heptylphenyl)benzoate Openeye Name: (2-fluoro-3-pyridyl) 2-chloro-4-(4-heptylphenyl)benzoate CAS Name: 2-chloro-4-(4-heptylphenyl)benzoic acid (2-fluoro-3-pyridinyl) ester IUPAC Name: (2-fluoropyridin-3-yl) 2-chloro-4-(4-heptylphenyl)benzoate Traditional Name: 2-chloro-4-(4-heptylphenyl)benzoic acid (2-fluoro-3-pyridyl) ester Formula: C25H25ClFNO2 MolecularWeight: 425.922903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=C(N=CC=C3)F)Cl

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=C(N=CC=C3)F)Cl

InChI

InChI=1S/C25H25ClFNO2/c1-2-3-4-5-6-8-18-10-12-19(13-11-18)20-14-15-21(22(26)17-20)25(29)30-23-9-7-16-28-24(23)27/h7,9-17H,2-6,8H2,1H3