N-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)ethanamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)acetamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-2-(4-nitrophenyl)acetamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)acetamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)acetamide Formula: C13H19N4O3+ MolecularWeight: 279.31496

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O3/c1-15-6-8-16(9-7-15)14-13(18)10-11-2-4-12(5-3-11)17(19)20/h2-5H,6-10H2,1H3,(H,14,18)/p+1