N-[5-(4-ethanoylpiperazin-1-yl)-2-nitro-phenyl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[5-(4-ethanoylpiperazin-1-yl)-2-nitro-phenyl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[5-(4-acetylpiperazin-1-yl)-2-nitro-phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[5-(4-acetyl-1-piperazinyl)-2-nitrophenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[5-(4-acetylpiperazin-1-yl)-2-nitrophenyl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[5-(4-acetylpiperazino)-2-nitro-phenyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C18H26N5O5+ MolecularWeight: 392.42954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)C[NH+]3CCOCC3

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C18H25N5O5/c1-14(24)21-4-6-22(7-5-21)15-2-3-17(23(26)27)16(12-15)19-18(25)13-20-8-10-28-11-9-20/h2-3,12H,4-11,13H2,1H3,(H,19,25)/p+1