1-[3-nitro-4-(4-propylpiperazin-4-ium-1-yl)phenyl]ethanone

Systemtic Name: 1-[3-nitro-4-(4-propylpiperazin-4-ium-1-yl)phenyl]ethanone Openeye Name: 1-[3-nitro-4-(4-propylpiperazin-4-ium-1-yl)phenyl]ethanone CAS Name: 1-[3-nitro-4-(4-propyl-1-piperazin-4-iumyl)phenyl]ethanone IUPAC Name: 1-[3-nitro-4-(4-propylpiperazin-4-ium-1-yl)phenyl]ethanone Traditional Name: 1-[3-nitro-4-(4-propylpiperazin-4-ium-1-yl)phenyl]ethanone Formula: C15H22N3O3+ MolecularWeight: 292.35348

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCC[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O3/c1-3-6-16-7-9-17(10-8-16)14-5-4-13(12(2)19)11-15(14)18(20)21/h4-5,11H,3,6-10H2,1-2H3/p+1