1-[3-fluoranyl-4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]phenyl]pentane-1,4-dione

Systemtic Name: 1-[3-fluoranyl-4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]phenyl]pentane-1,4-dione Openeye Name: 1-[3-fluoro-4-[[3-(2-quinolylmethoxy)phenyl]methoxy]phenyl]pentane-1,4-dione CAS Name: 1-[3-fluoro-4-[[3-(2-quinolinylmethoxy)phenyl]methoxy]phenyl]pentane-1,4-dione IUPAC Name: 1-[3-fluoro-4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]phenyl]pentane-1,4-dione Traditional Name: 1-[3-fluoro-4-[3-(2-quinolylmethoxy)benzyl]oxy-phenyl]pentane-1,4-dione Formula: C28H24FNO4 MolecularWeight: 457.492863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)C1=CC(=C(C=C1)OCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)F

Isomeric SMILES

CC(=O)CCC(=O)C1=CC(=C(C=C1)OCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)F

InChI

InChI=1S/C28H24FNO4/c1-19(31)9-13-27(32)22-11-14-28(25(29)16-22)34-17-20-5-4-7-24(15-20)33-18-23-12-10-21-6-2-3-8-26(21)30-23/h2-8,10-12,14-16H,9,13,17-18H2,1H3