2-[4-[3-(2-fluoranylphenoxy)-2-oxidanyl-propyl]-3-methyl-piperazin-1-yl]-N-quinolin-8-yl-ethanamide

Systemtic Name: 2-[4-[3-(2-fluoranylphenoxy)-2-oxidanyl-propyl]-3-methyl-piperazin-1-yl]-N-quinolin-8-yl-ethanamide Openeye Name: 2-[4-[3-(2-fluorophenoxy)-2-hydroxy-propyl]-3-methyl-piperazin-1-yl]-N-(8-quinolyl)acetamide CAS Name: 2-[4-[3-(2-fluorophenoxy)-2-hydroxypropyl]-3-methyl-1-piperazinyl]-N-(8-quinolinyl)acetamide IUPAC Name: 2-[4-[3-(2-fluorophenoxy)-2-hydroxypropyl]-3-methylpiperazin-1-yl]-N-quinolin-8-ylacetamide Traditional Name: 2-[4-[3-(2-fluorophenoxy)-2-hydroxy-propyl]-3-methyl-piperazino]-N-(8-quinolyl)acetamide Formula: C25H29FN4O3 MolecularWeight: 452.521163

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC(COC2=CC=CC=C2F)O)CC(=O)NC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1CN(CCN1CC(COC2=CC=CC=C2F)O)CC(=O)NC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C25H29FN4O3/c1-18-14-29(16-24(32)28-22-9-4-6-19-7-5-11-27-25(19)22)12-13-30(18)15-20(31)17-33-23-10-3-2-8-21(23)26/h2-11,18,20,31H,12-17H2,1H3,(H,28,32)