2-[4-(5-morpholin-4-yl-2-nitro-phenyl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(5-morpholin-4-yl-2-nitro-phenyl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(5-morpholino-2-nitro-phenyl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-[5-(4-morpholinyl)-2-nitrophenyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(5-morpholin-4-yl-2-nitrophenyl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(5-morpholino-2-nitro-phenyl)piperazin-1-ium-1-yl]ethanol Formula: C16H25N4O4+ MolecularWeight: 337.3941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O4/c21-10-7-17-3-5-19(6-4-17)16-13-14(1-2-15(16)20(22)23)18-8-11-24-12-9-18/h1-2,13,21H,3-12H2/p+1