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

Systemtic Name: 5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one CAS Name: 5-nitro-6-(1-piperazin-4-iumyl)-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-nitro-6-piperazin-4-ium-1-yl-1,3-dihydrobenzimidazol-2-one Formula: C11H14N5O3+ MolecularWeight: 264.26056

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O3/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)/p+1