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

Systemtic Name: 2-[4-(4-fluoranylbenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propyl-propanamide Openeye Name: 2-[4-(4-fluorobenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propyl-propanamide CAS Name: 2-[4-(4-fluoro-6-benzo[b][1]benzoxepinyl)-1-piperazinyl]-N-propylpropanamide IUPAC Name: 2-[4-(4-fluorobenzo[b][1]benzoxepin-6-yl)piperazin-1-yl]-N-propylpropanamide Traditional Name: 2-[4-(4-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=CC3=C(C=CC=C3F)OC4=CC=CC=C42

Isomeric SMILES

CCCNC(=O)C(C)N1CCN(CC1)C2=CC3=C(C=CC=C3F)OC4=CC=CC=C42

InChI

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