2-(3-fluoranyl-4-pentoxy-phenyl)-5-(4-hexylphenyl)pyrazine

Systemtic Name: 2-(3-fluoranyl-4-pentoxy-phenyl)-5-(4-hexylphenyl)pyrazine Openeye Name: 2-(3-fluoro-4-pentoxy-phenyl)-5-(4-hexylphenyl)pyrazine CAS Name: 2-(3-fluoro-4-pentoxyphenyl)-5-(4-hexylphenyl)pyrazine IUPAC Name: 2-(3-fluoro-4-pentoxyphenyl)-5-(4-hexylphenyl)pyrazine Traditional Name: 2-(4-amoxy-3-fluoro-phenyl)-5-(4-hexylphenyl)pyrazine Formula: C27H33FN2O MolecularWeight: 420.562123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C3=CC(=C(C=C3)OCCCCC)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C3=CC(=C(C=C3)OCCCCC)F

InChI

InChI=1S/C27H33FN2O/c1-3-5-7-8-10-21-11-13-22(14-12-21)25-19-30-26(20-29-25)23-15-16-27(24(28)18-23)31-17-9-6-4-2/h11-16,18-20H,3-10,17H2,1-2H3