2-[4-(5-fluoranylbenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propyl-propanamide

Systemtic Name: 2-[4-(5-fluoranylbenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propyl-propanamide Openeye Name: 2-[4-(5-fluorobenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propyl-propanamide CAS Name: 2-[4-(5-fluoro-6-benzo[b][1]benzoxepinyl)-1-piperazinyl]-N-propylpropanamide IUPAC Name: 2-[4-(5-fluorobenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propylpropanamide Traditional Name: 2-[4-(5-fluorobenzo[b][1]benzoxepin-6-yl)piperazino]-N-propyl-propionamide Formula: C24H28FN3O2 MolecularWeight: 409.496423

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)N1CCN(CC1)C2=C(C3=CC=CC=C3OC4=CC=CC=C42)F

Isomeric SMILES

CCCNC(=O)C(C)N1CCN(CC1)C2=C(C3=CC=CC=C3OC4=CC=CC=C42)F

InChI

InChI=1S/C24H28FN3O2/c1-3-12-26-24(29)17(2)27-13-15-28(16-14-27)23-19-9-5-7-11-21(19)30-20-10-6-4-8-18(20)22(23)25/h4-11,17H,3,12-16H2,1-2H3,(H,26,29)