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

Systemtic Name: 3-fluoranyl-N-[6-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-phenyl-benzamide Openeye Name: 3-fluoro-N-[6-methyl-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]-4-phenyl-benzamide CAS Name: 3-fluoro-N-[6-methyl-3-(1-pyrrolidinylmethyl)-7-quinolinyl]-4-phenylbenzamide IUPAC Name: 3-fluoro-N-[6-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-phenylbenzamide Traditional Name: 3-fluoro-N-[6-methyl-3-(pyrrolidinomethyl)-7-quinolyl]-4-phenyl-benzamide Formula: C28H26FN3O MolecularWeight: 439.523943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CN=C2C=C1NC(=O)C3=CC(=C(C=C3)C4=CC=CC=C4)F)CN5CCCC5

Isomeric SMILES

CC1=CC2=CC(=CN=C2C=C1NC(=O)C3=CC(=C(C=C3)C4=CC=CC=C4)F)CN5CCCC5

InChI

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