3-fluoranyl-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-phenyl-benzamide

Systemtic Name: 3-fluoranyl-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-phenyl-benzamide Openeye Name: 3-fluoro-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]-4-phenyl-benzamide CAS Name: 3-fluoro-N-[8-methyl-3-(1-pyrrolidinylmethyl)-7-quinolinyl]-4-phenylbenzamide IUPAC Name: 3-fluoro-N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-phenylbenzamide Traditional Name: 3-fluoro-N-[8-methyl-3-(pyrrolidinomethyl)-7-quinolyl]-4-phenyl-benzamide Formula: C28H26FN3O MolecularWeight: 439.523943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26FN3O/c1-19-26(12-10-22-15-20(17-30-27(19)22)18-32-13-5-6-14-32)31-28(33)23-9-11-24(25(29)16-23)21-7-3-2-4-8-21/h2-4,7-12,15-17H,5-6,13-14,18H2,1H3,(H,31,33)