pyrazin-2-yl 2-fluoranyl-5-(4-hexylphenyl)-4-nonyl-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=C(C=C1C2=CC=C(C=C2)CCCCCC)C(=O)OC3=NC=CN=C3)F

Isomeric SMILES

CCCCCCCCCC1=CC(=C(C=C1C2=CC=C(C=C2)CCCCCC)C(=O)OC3=NC=CN=C3)F

InChI

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