pyrazin-2-yl 5-(4-butylphenyl)-4-ethyl-2-fluoranyl-benzoate

Systemtic Name: pyrazin-2-yl 5-(4-butylphenyl)-4-ethyl-2-fluoranyl-benzoate Openeye Name: pyrazin-2-yl 5-(4-butylphenyl)-4-ethyl-2-fluoro-benzoate CAS Name: 5-(4-butylphenyl)-4-ethyl-2-fluorobenzoic acid 2-pyrazinyl ester IUPAC Name: pyrazin-2-yl 5-(4-butylphenyl)-4-ethyl-2-fluorobenzoate Traditional Name: 5-(4-butylphenyl)-4-ethyl-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=C1)C2=CC(=C(C=C2CC)F)C(=O)OC3=NC=CN=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CC(=C(C=C2CC)F)C(=O)OC3=NC=CN=C3

InChI

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