N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoranyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoranyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-2-(1-methyl-2-pyrrolyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Traditional Name: 6-fluoro-N-homoveratryl-2-(1-methylpyrrol-2-yl)cinchoninamide Formula: C25H24FN3O3 MolecularWeight: 433.474763

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C=CC=C1C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H24FN3O3/c1-29-12-4-5-22(29)21-15-19(18-14-17(26)7-8-20(18)28-21)25(30)27-11-10-16-6-9-23(31-2)24(13-16)32-3/h4-9,12-15H,10-11H2,1-3H3,(H,27,30)