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

Systemtic Name: N-[8-fluoranyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)benzamide Openeye Name: N-[8-fluoro-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]-4-(p-tolyl)benzamide CAS Name: N-[8-fluoro-3-(1-pyrrolidinylmethyl)-7-quinolinyl]-4-(4-methylphenyl)benzamide IUPAC Name: N-[8-fluoro-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)benzamide Traditional Name: N-[8-fluoro-3-(pyrrolidinomethyl)-7-quinolyl]-4-(p-tolyl)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=C(C4=NC=C(C=C4C=C3)CN5CCCC5)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(C4=NC=C(C=C4C=C3)CN5CCCC5)F

InChI

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