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

Systemtic Name: 2-fluoranyl-4-(4-methylphenyl)-N-[3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]benzamide Openeye Name: 2-fluoro-4-(p-tolyl)-N-[3-(pyrrolidin-1-ylmethyl)-7-quinolyl]benzamide CAS Name: 2-fluoro-4-(4-methylphenyl)-N-[3-(1-pyrrolidinylmethyl)-7-quinolinyl]benzamide IUPAC Name: 2-fluoro-4-(4-methylphenyl)-N-[3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]benzamide Traditional Name: 2-fluoro-4-(p-tolyl)-N-[3-(pyrrolidinomethyl)-7-quinolyl]benzamide Formula: C28H26FN3O MolecularWeight: 439.523943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)NC3=CC4=NC=C(C=C4C=C3)CN5CCCC5)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)NC3=CC4=NC=C(C=C4C=C3)CN5CCCC5)F

InChI

InChI=1S/C28H26FN3O/c1-19-4-6-21(7-5-19)22-9-11-25(26(29)15-22)28(33)31-24-10-8-23-14-20(17-30-27(23)16-24)18-32-12-2-3-13-32/h4-11,14-17H,2-3,12-13,18H2,1H3,(H,31,33)