4-(1,3-benzodioxol-5-yl)-2-fluoranyl-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]benzamide

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-fluoranyl-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]benzamide Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-fluoro-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]benzamide CAS Name: 4-(1,3-benzodioxol-5-yl)-2-fluoro-N-[8-methyl-3-(1-pyrrolidinylmethyl)-7-quinolinyl]benzamide IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-fluoro-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]benzamide Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-fluoro-N-[8-methyl-3-(pyrrolidinomethyl)-7-quinolyl]benzamide Formula: C29H26FN3O3 MolecularWeight: 483.533443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=CC(=CN=C12)CN3CCCC3)NC(=O)C4=C(C=C(C=C4)C5=CC6=C(C=C5)OCO6)F

Isomeric SMILES

CC1=C(C=CC2=CC(=CN=C12)CN3CCCC3)NC(=O)C4=C(C=C(C=C4)C5=CC6=C(C=C5)OCO6)F

InChI

InChI=1S/C29H26FN3O3/c1-18-25(8-5-22-12-19(15-31-28(18)22)16-33-10-2-3-11-33)32-29(34)23-7-4-20(13-24(23)30)21-6-9-26-27(14-21)36-17-35-26/h4-9,12-15H,2-3,10-11,16-17H2,1H3,(H,32,34)