2-piperazine-1,4-diium-1-ylethyl-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylidene]azanium

Systemtic Name: 2-piperazine-1,4-diium-1-ylethyl-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylidene]azanium Openeye Name: 2-piperazine-1,4-diium-1-ylethyl-[(2,4,6-trioxohexahydropyrimidin-5-yl)methylene]ammonium CAS Name: 2-(1-piperazine-1,4-diiumyl)ethyl-[(2,4,6-trioxo-1,3-diazinan-5-yl)methylidene]ammonium IUPAC Name: 2-piperazine-1,4-diium-1-ylethyl-[(2,4,6-trioxo-1,3-diazinan-5-yl)methylidene]azanium Traditional Name: 2-piperazine-1,4-diium-1-ylethyl-[(2,4,6-triketohexahydropyrimidin-5-yl)methylene]ammonium Formula: C11H20N5O3+3 MolecularWeight: 270.3082

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC[NH+]=CC2C(=O)NC(=O)NC2=O

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CC[NH+]=CC2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C11H17N5O3/c17-9-8(10(18)15-11(19)14-9)7-13-3-6-16-4-1-12-2-5-16/h7-8,12H,1-6H2,(H2,14,15,17,18,19)/p+3