N-(1,3-benzodioxol-5-ylmethyl)-6-fluoranyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoranyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-2-(1-methyl-2-pyrrolyl)-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Traditional Name: 6-fluoro-2-(1-methylpyrrol-2-yl)-N-piperonyl-cinchoninamide Formula: C23H18FN3O3 MolecularWeight: 403.405723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=CC=C1C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H18FN3O3/c1-27-8-2-3-20(27)19-11-17(16-10-15(24)5-6-18(16)26-19)23(28)25-12-14-4-7-21-22(9-14)30-13-29-21/h2-11H,12-13H2,1H3,(H,25,28)