N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3-nitrophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C18H21N4O3+ MolecularWeight: 341.38434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O3/c23-18(19-15-5-4-8-17(13-15)22(24)25)14-20-9-11-21(12-10-20)16-6-2-1-3-7-16/h1-8,13H,9-12,14H2,(H,19,23)/p+1