3-[4-(2-fluorophenyl)piperazin-1-yl]azepan-2-one

Systemtic Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]azepan-2-one Openeye Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]azepan-2-one CAS Name: 3-[4-(2-fluorophenyl)-1-piperazinyl]-2-azepanone IUPAC Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]azepan-2-one Traditional Name: 3-[4-(2-fluorophenyl)piperazino]azepan-2-one Formula: C16H22FN3O MolecularWeight: 291.363783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

C1CCNC(=O)C(C1)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C16H22FN3O/c17-13-5-1-2-6-14(13)19-9-11-20(12-10-19)15-7-3-4-8-18-16(15)21/h1-2,5-6,15H,3-4,7-12H2,(H,18,21)