2-[2-(3-fluoranyl-4-pentoxy-phenyl)dodecyl]pyridine

Systemtic Name: 2-[2-(3-fluoranyl-4-pentoxy-phenyl)dodecyl]pyridine Openeye Name: 2-[2-(3-fluoro-4-pentoxy-phenyl)dodecyl]pyridine CAS Name: 2-[2-(3-fluoro-4-pentoxyphenyl)dodecyl]pyridine IUPAC Name: 2-[2-(3-fluoro-4-pentoxyphenyl)dodecyl]pyridine Traditional Name: 2-[2-(4-amoxy-3-fluoro-phenyl)dodecyl]pyridine Formula: C28H42FNO MolecularWeight: 427.637583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC1=CC=CC=N1)C2=CC(=C(C=C2)OCCCCC)F

Isomeric SMILES

CCCCCCCCCCC(CC1=CC=CC=N1)C2=CC(=C(C=C2)OCCCCC)F

InChI

InChI=1S/C28H42FNO/c1-3-5-7-8-9-10-11-12-16-24(22-26-17-13-14-20-30-26)25-18-19-28(27(29)23-25)31-21-15-6-4-2/h13-14,17-20,23-24H,3-12,15-16,21-22H2,1-2H3