1-[4-(2-fluoranyl-5-methyl-4-nitro-phenyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-(2-fluoranyl-5-methyl-4-nitro-phenyl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-(2-fluoro-5-methyl-4-nitro-phenyl)piperazin-1-yl]pentan-1-one CAS Name: 1-[4-(2-fluoro-5-methyl-4-nitrophenyl)-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-(2-fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-(2-fluoro-5-methyl-4-nitro-phenyl)piperazino]pentan-1-one Formula: C16H22FN3O3 MolecularWeight: 323.362583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=C(C=C(C(=C2)C)[N+](=O)[O-])F

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=C(C=C(C(=C2)C)[N+](=O)[O-])F

InChI

InChI=1S/C16H22FN3O3/c1-3-4-5-16(21)19-8-6-18(7-9-19)15-10-12(2)14(20(22)23)11-13(15)17/h10-11H,3-9H2,1-2H3