(4-butylphenyl) 4-(5-butylpyrazin-2-yl)-2-fluoranyl-benzoate

Systemtic Name: (4-butylphenyl) 4-(5-butylpyrazin-2-yl)-2-fluoranyl-benzoate Openeye Name: (4-butylphenyl) 4-(5-butylpyrazin-2-yl)-2-fluoro-benzoate CAS Name: 4-(5-butyl-2-pyrazinyl)-2-fluorobenzoic acid (4-butylphenyl) ester IUPAC Name: (4-butylphenyl) 4-(5-butylpyrazin-2-yl)-2-fluorobenzoate Traditional Name: 4-(5-butylpyrazin-2-yl)-2-fluoro-benzoic acid (4-butylphenyl) ester Formula: C25H27FN2O2 MolecularWeight: 406.492483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)C3=CN=C(C=N3)CCCC)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)C3=CN=C(C=N3)CCCC)F

InChI

InChI=1S/C25H27FN2O2/c1-3-5-7-18-9-12-21(13-10-18)30-25(29)22-14-11-19(15-23(22)26)24-17-27-20(16-28-24)8-6-4-2/h9-17H,3-8H2,1-2H3