2,2-dimethyl-1-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[4-[4-nitro-3-(1-piperidyl)phenyl]piperazin-1-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-(4-nitro-3-piperidin-1-ylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[4-(4-nitro-3-piperidino-phenyl)piperazino]propan-1-one Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4O3/c1-20(2,3)19(25)23-13-11-21(12-14-23)16-7-8-17(24(26)27)18(15-16)22-9-5-4-6-10-22/h7-8,15H,4-6,9-14H2,1-3H3