N-[2-(1,4-dimethyl-4-propyl-piperazin-4-ium-2-yl)oxy-5-nitro-phenyl]ethanamide

Systemtic Name: N-[2-(1,4-dimethyl-4-propyl-piperazin-4-ium-2-yl)oxy-5-nitro-phenyl]ethanamide Openeye Name: N-[2-(1,4-dimethyl-4-propyl-piperazin-4-ium-2-yl)oxy-5-nitro-phenyl]acetamide CAS Name: N-[2-[(1,4-dimethyl-4-propyl-2-piperazin-4-iumyl)oxy]-5-nitrophenyl]acetamide IUPAC Name: N-[2-(1,4-dimethyl-4-propylpiperazin-4-ium-2-yl)oxy-5-nitrophenyl]acetamide Traditional Name: N-[2-(1,4-dimethyl-4-propyl-piperazin-4-ium-2-yl)oxy-5-nitro-phenyl]acetamide Formula: C17H27N4O4+ MolecularWeight: 351.42068

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(CCN(C(C1)OC2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)C)C)C

Isomeric SMILES

CCC[N+]1(CCN(C(C1)OC2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)C)C)C

InChI

InChI=1S/C17H26N4O4/c1-5-9-21(4)10-8-19(3)17(12-21)25-16-7-6-14(20(23)24)11-15(16)18-13(2)22/h6-7,11,17H,5,8-10,12H2,1-4H3/p+1