2-[4-(3-azanyl-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(3-azanyl-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(3-amino-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(3-amino-4-nitrophenyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(3-amino-4-nitrophenyl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(3-amino-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol Formula: C12H19N4O3+ MolecularWeight: 267.30426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N4O3/c13-11-9-10(1-2-12(11)16(18)19)15-5-3-14(4-6-15)7-8-17/h1-2,9,17H,3-8,13H2/p+1