pyrazin-2-yl 4-butyl-5-(4-ethylphenyl)-2-fluoranyl-benzoate

Systemtic Name: pyrazin-2-yl 4-butyl-5-(4-ethylphenyl)-2-fluoranyl-benzoate Openeye Name: pyrazin-2-yl 4-butyl-5-(4-ethylphenyl)-2-fluoro-benzoate CAS Name: 4-butyl-5-(4-ethylphenyl)-2-fluorobenzoic acid 2-pyrazinyl ester IUPAC Name: pyrazin-2-yl 4-butyl-5-(4-ethylphenyl)-2-fluorobenzoate Traditional Name: 4-butyl-5-(4-ethylphenyl)-2-fluoro-benzoic acid pyrazin-2-yl ester Formula: C23H23FN2O2 MolecularWeight: 378.439323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1C2=CC=C(C=C2)CC)C(=O)OC3=NC=CN=C3)F

Isomeric SMILES

CCCCC1=CC(=C(C=C1C2=CC=C(C=C2)CC)C(=O)OC3=NC=CN=C3)F

InChI

InChI=1S/C23H23FN2O2/c1-3-5-6-18-13-21(24)20(23(27)28-22-15-25-11-12-26-22)14-19(18)17-9-7-16(4-2)8-10-17/h7-15H,3-6H2,1-2H3