N-cyclopropyl-N-[[7-fluoranyl-2-(4-methoxyphenyl)quinolin-3-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-cyclopropyl-N-[[7-fluoranyl-2-(4-methoxyphenyl)quinolin-3-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-cyclopropyl-N-[[7-fluoro-2-(4-methoxyphenyl)-3-quinolyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-cyclopropyl-N-[[7-fluoro-2-(4-methoxyphenyl)-3-quinolinyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-cyclopropyl-N-[[7-fluoro-2-(4-methoxyphenyl)quinolin-3-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-cyclopropyl-N-[[7-fluoro-2-(4-methoxyphenyl)-3-quinolyl]methyl]-piperonylamide Formula: C28H23FN2O4 MolecularWeight: 470.491623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=C3C=CC(=CC3=N2)F)CN(C4CC4)C(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=C3C=CC(=CC3=N2)F)CN(C4CC4)C(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H23FN2O4/c1-33-23-9-3-17(4-10-23)27-20(12-18-2-6-21(29)14-24(18)30-27)15-31(22-7-8-22)28(32)19-5-11-25-26(13-19)35-16-34-25/h2-6,9-14,22H,7-8,15-16H2,1H3