3-[(4-azanyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]propylazanium

Systemtic Name: 3-[(4-azanyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]propylazanium Openeye Name: 3-[(4-amino-5-nitro-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]propylammonium CAS Name: 3-[[4-amino-5-nitro-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]propylammonium IUPAC Name: 3-[(4-amino-5-nitro-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]propylazanium Traditional Name: 3-[(4-amino-5-nitro-6-pyrrolidino-pyrimidin-2-yl)amino]propylammonium Formula: C11H20N7O2+ MolecularWeight: 282.3222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC(=N2)NCCC[NH3+])N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC(=N2)NCCC[NH3+])N)[N+](=O)[O-]

InChI

InChI=1S/C11H19N7O2/c12-4-3-5-14-11-15-9(13)8(18(19)20)10(16-11)17-6-1-2-7-17/h1-7,12H2,(H3,13,14,15,16)/p+1