2-fluoranyl-4-[5-[6-(hydroxymethyl)-4-oxidanylidene-pyran-3-yl]oxypentoxy]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[5-[6-(hydroxymethyl)-4-oxidanylidene-pyran-3-yl]oxypentoxy]benzenecarbonitrile Openeye Name: 2-fluoro-4-[5-[6-(hydroxymethyl)-4-oxo-pyran-3-yl]oxypentoxy]benzonitrile CAS Name: 2-fluoro-4-[5-[[6-(hydroxymethyl)-4-oxo-3-pyranyl]oxy]pentoxy]benzonitrile IUPAC Name: 2-fluoro-4-[5-[6-(hydroxymethyl)-4-oxopyran-3-yl]oxypentoxy]benzonitrile Traditional Name: 2-fluoro-4-[5-(4-keto-6-methylol-pyran-3-yl)oxypentoxy]benzonitrile Formula: C18H18FNO5 MolecularWeight: 347.337623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCCCCCOC2=COC(=CC2=O)CO)F)C#N

Isomeric SMILES

C1=CC(=C(C=C1OCCCCCOC2=COC(=CC2=O)CO)F)C#N

InChI

InChI=1S/C18H18FNO5/c19-16-8-14(5-4-13(16)10-20)23-6-2-1-3-7-24-18-12-25-15(11-21)9-17(18)22/h4-5,8-9,12,21H,1-3,6-7,11H2