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5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one chloride

5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one chloride

Systemtic Name:5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one chloride
Openeye Name:5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one chloride
CAS Name:5-nitro-6-(1-piperazin-4-iumyl)-1,3-dihydrobenzimidazol-2-one chloride
IUPAC Name:5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one chloride
Traditional Name:5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one chloride
Formula: C11H14ClN5O3
MolecularWeight: 299.71356
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C(C=C3C(=C2)NC(=O)N3)[N+](=O)[O-].[Cl-]


Isomeric SMILES

C1CN(CC[NH2+]1)C2=C(C=C3C(=C2)NC(=O)N3)[N+](=O)[O-].[Cl-]


InChI

InChI=1S/C11H13N5O3.ClH/c17-11-13-7-5-9(15-3-1-12-2-4-15)10(16(18)19)6-8(7)14-11;/h5-6,12H,1-4H2,(H2,13,14,17);1H


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