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

Systemtic Name: 1-[4-[5-(4-ethylpiperazin-1-yl)-4-fluoranyl-2-nitro-phenyl]piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-[5-(4-ethylpiperazin-1-yl)-4-fluoro-2-nitro-phenyl]piperazin-1-yl]pentan-1-one CAS Name: 1-[4-[5-(4-ethyl-1-piperazinyl)-4-fluoro-2-nitrophenyl]-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-[5-(4-ethylpiperazin-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-[5-(4-ethylpiperazino)-4-fluoro-2-nitro-phenyl]piperazino]pentan-1-one Formula: C21H32FN5O3 MolecularWeight: 421.508883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCN(CC3)CC

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCN(CC3)CC

InChI

InChI=1S/C21H32FN5O3/c1-3-5-6-21(28)26-13-11-25(12-14-26)19-16-18(17(22)15-20(19)27(29)30)24-9-7-23(4-2)8-10-24/h15-16H,3-14H2,1-2H3