3-[1-(5-nitro-2-oxidanyl-phenoxy)propyl]-1-piperazin-1-yl-pyrimidine-2,4-dione

Systemtic Name: 3-[1-(5-nitro-2-oxidanyl-phenoxy)propyl]-1-piperazin-1-yl-pyrimidine-2,4-dione Openeye Name: 3-[1-(2-hydroxy-5-nitro-phenoxy)propyl]-1-piperazin-1-yl-pyrimidine-2,4-dione CAS Name: 3-[1-(2-hydroxy-5-nitrophenoxy)propyl]-1-(1-piperazinyl)pyrimidine-2,4-dione IUPAC Name: 3-[1-(2-hydroxy-5-nitrophenoxy)propyl]-1-piperazin-1-ylpyrimidine-2,4-dione Traditional Name: 3-[1-(2-hydroxy-5-nitro-phenoxy)propyl]-1-piperazino-pyrimidine-2,4-quinone Formula: C17H21N5O6 MolecularWeight: 391.37854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C(=O)C=CN(C1=O)N2CCNCC2)OC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CCC(N1C(=O)C=CN(C1=O)N2CCNCC2)OC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H21N5O6/c1-2-16(28-14-11-12(22(26)27)3-4-13(14)23)21-15(24)5-8-20(17(21)25)19-9-6-18-7-10-19/h3-5,8,11,16,18,23H,2,6-7,9-10H2,1H3