(4-hexylphenyl) 2-fluoranyl-4-(5-nonylpyrazin-2-yl)benzoate

Systemtic Name: (4-hexylphenyl) 2-fluoranyl-4-(5-nonylpyrazin-2-yl)benzoate Openeye Name: (4-hexylphenyl) 2-fluoro-4-(5-nonylpyrazin-2-yl)benzoate CAS Name: 2-fluoro-4-(5-nonyl-2-pyrazinyl)benzoic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 2-fluoro-4-(5-nonylpyrazin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-nonylpyrazin-2-yl)benzoic acid (4-hexylphenyl) ester Formula: C32H41FN2O2 MolecularWeight: 504.678543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NC=C(N=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCCC)F

Isomeric SMILES

CCCCCCCCCC1=NC=C(N=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCCC)F

InChI

InChI=1S/C32H41FN2O2/c1-3-5-7-9-10-11-13-15-27-23-35-31(24-34-27)26-18-21-29(30(33)22-26)32(36)37-28-19-16-25(17-20-28)14-12-8-6-4-2/h16-24H,3-15H2,1-2H3