1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-fluoranylphenoxy)propan-1-one

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-fluoranylphenoxy)propan-1-one Openeye Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-fluorophenoxy)propan-1-one CAS Name: 1-[4-(1-azepanylsulfonyl)-1-piperazinyl]-2-(4-fluorophenoxy)-1-propanone IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-fluorophenoxy)propan-1-one Traditional Name: 1-[4-(azepan-1-ylsulfonyl)piperazino]-2-(4-fluorophenoxy)propan-1-one Formula: C19H28FN3O4S MolecularWeight: 413.506723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)N2CCCCCC2)OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)N2CCCCCC2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C19H28FN3O4S/c1-16(27-18-8-6-17(20)7-9-18)19(24)21-12-14-23(15-13-21)28(25,26)22-10-4-2-3-5-11-22/h6-9,16H,2-5,10-15H2,1H3