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

Systemtic Name: 2-[2-[(4-azanyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]ethoxy]ethanol Openeye Name: 2-[2-[(4-amino-5-nitro-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]ethoxy]ethanol CAS Name: 2-[2-[[4-amino-5-nitro-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[(4-amino-5-nitro-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]ethoxy]ethanol Traditional Name: 2-[2-[(4-amino-5-nitro-6-pyrrolidino-pyrimidin-2-yl)amino]ethoxy]ethanol Formula: C12H20N6O4 MolecularWeight: 312.325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N6O4/c13-10-9(18(20)21)11(17-4-1-2-5-17)16-12(15-10)14-3-7-22-8-6-19/h19H,1-8H2,(H3,13,14,15,16)