2-fluoranyl-N-[6-fluoranyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)benzamide

Systemtic Name: 2-fluoranyl-N-[6-fluoranyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)benzamide Openeye Name: 2-fluoro-N-[6-fluoro-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]-4-(p-tolyl)benzamide CAS Name: 2-fluoro-N-[6-fluoro-3-(1-pyrrolidinylmethyl)-7-quinolinyl]-4-(4-methylphenyl)benzamide IUPAC Name: 2-fluoro-N-[6-fluoro-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)benzamide Traditional Name: 2-fluoro-N-[6-fluoro-3-(pyrrolidinomethyl)-7-quinolyl]-4-(p-tolyl)benzamide Formula: C28H25F2N3O MolecularWeight: 457.514406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)NC3=CC4=NC=C(C=C4C=C3F)CN5CCCC5)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)NC3=CC4=NC=C(C=C4C=C3F)CN5CCCC5)F

InChI

InChI=1S/C28H25F2N3O/c1-18-4-6-20(7-5-18)21-8-9-23(24(29)13-21)28(34)32-27-15-26-22(14-25(27)30)12-19(16-31-26)17-33-10-2-3-11-33/h4-9,12-16H,2-3,10-11,17H2,1H3,(H,32,34)