dimethyl-[3-[(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]propyl]azanium

Systemtic Name: dimethyl-[3-[(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]propyl]azanium Openeye Name: dimethyl-[3-[(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]propyl]ammonium CAS Name: dimethyl-[3-[[5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(5-nitro-6-pyrrolidin-1-ylpyrimidin-4-yl)amino]propyl]azanium Traditional Name: dimethyl-[3-[(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amino]propyl]ammonium Formula: C13H23N6O2+ MolecularWeight: 295.36072

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

Isomeric SMILES

C[NH+](C)CCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C13H22N6O2/c1-17(2)7-5-6-14-12-11(19(20)21)13(16-10-15-12)18-8-3-4-9-18/h10H,3-9H2,1-2H3,(H,14,15,16)/p+1