1-(2,4-dinitropyridin-1-ium-1-yl)-3-phenyl-urea

Systemtic Name: 1-(2,4-dinitropyridin-1-ium-1-yl)-3-phenyl-urea Openeye Name: 1-(2,4-dinitropyridin-1-ium-1-yl)-3-phenyl-urea CAS Name: 1-(2,4-dinitro-1-pyridin-1-iumyl)-3-phenylurea IUPAC Name: 1-(2,4-dinitropyridin-1-ium-1-yl)-3-phenylurea Traditional Name: 1-(2,4-dinitropyridin-1-ium-1-yl)-3-phenyl-urea Formula: C12H10N5O5+ MolecularWeight: 304.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)N[N+]2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)N[N+]2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O5/c18-12(13-9-4-2-1-3-5-9)14-15-7-6-10(16(19)20)8-11(15)17(21)22/h1-8H,(H-,13,14,18)/p+1