1-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-[4-nitro-3-(1-piperidyl)phenyl]piperazin-1-yl]pentan-1-one CAS Name: 1-[4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-(4-nitro-3-piperidin-1-ylphenyl)piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-(4-nitro-3-piperidino-phenyl)piperazino]pentan-1-one Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C20H30N4O3/c1-2-3-7-20(25)23-14-12-21(13-15-23)17-8-9-18(24(26)27)19(16-17)22-10-5-4-6-11-22/h8-9,16H,2-7,10-15H2,1H3