morpholin-4-yl-(5-nitro-2-piperazin-4-ium-1-yl-phenyl)methanone

Systemtic Name: morpholin-4-yl-(5-nitro-2-piperazin-4-ium-1-yl-phenyl)methanone Openeye Name: morpholino-(5-nitro-2-piperazin-4-ium-1-yl-phenyl)methanone CAS Name: 4-morpholinyl-[5-nitro-2-(1-piperazin-4-iumyl)phenyl]methanone IUPAC Name: morpholin-4-yl-(5-nitro-2-piperazin-4-ium-1-ylphenyl)methanone Traditional Name: morpholino-(5-nitro-2-piperazin-4-ium-1-yl-phenyl)methanone Formula: C15H21N4O4+ MolecularWeight: 321.35164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCOCC3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCOCC3

InChI

InChI=1S/C15H20N4O4/c20-15(18-7-9-23-10-8-18)13-11-12(19(21)22)1-2-14(13)17-5-3-16-4-6-17/h1-2,11,16H,3-10H2/p+1