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

Systemtic Name: pyrazin-2-yl 4-ethyl-2-fluoranyl-5-(4-pentylphenyl)benzoate Openeye Name: pyrazin-2-yl 4-ethyl-2-fluoro-5-(4-pentylphenyl)benzoate CAS Name: 4-ethyl-2-fluoro-5-(4-pentylphenyl)benzoic acid 2-pyrazinyl ester IUPAC Name: pyrazin-2-yl 4-ethyl-2-fluoro-5-(4-pentylphenyl)benzoate Traditional Name: 5-(4-amylphenyl)-4-ethyl-2-fluoro-benzoic acid pyrazin-2-yl ester Formula: C24H25FN2O2 MolecularWeight: 392.465903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2CC)F)C(=O)OC3=NC=CN=C3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2CC)F)C(=O)OC3=NC=CN=C3

InChI

InChI=1S/C24H25FN2O2/c1-3-5-6-7-17-8-10-19(11-9-17)20-15-21(22(25)14-18(20)4-2)24(28)29-23-16-26-12-13-27-23/h8-16H,3-7H2,1-2H3