1-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanone

Systemtic Name: 1-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanone Openeye Name: 1-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanone CAS Name: 1-(4-cyclohexyl-1-piperazin-4-iumyl)-2-(4-nitrophenyl)ethanone IUPAC Name: 1-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanone Traditional Name: 1-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanone Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O3/c22-18(14-15-6-8-17(9-7-15)21(23)24)20-12-10-19(11-13-20)16-4-2-1-3-5-16/h6-9,16H,1-5,10-14H2/p+1