5-nitro-6-[(E)-2-(5-nitro-2-oxidanyl-phenyl)ethenyl]-1H-pyrimidine-2,4-dione; piperidine

Systemtic Name: 5-nitro-6-[(E)-2-(5-nitro-2-oxidanyl-phenyl)ethenyl]-1H-pyrimidine-2,4-dione; piperidine Openeye Name: 6-[(E)-2-(2-hydroxy-5-nitro-phenyl)vinyl]-5-nitro-1H-pyrimidine-2,4-dione; piperidine CAS Name: 6-[(E)-2-(2-hydroxy-5-nitrophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione; piperidine IUPAC Name: 6-[(E)-2-(2-hydroxy-5-nitrophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione; piperidine Traditional Name: 6-[(E)-2-(2-hydroxy-5-nitro-phenyl)vinyl]-5-nitro-uracil; piperidine Formula: C17H19N5O7 MolecularWeight: 405.36206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNCC1.C1=CC(=C(C=C1[N+](=O)[O-])C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])O

Isomeric SMILES

C1CCNCC1.C1=CC(=C(C=C1[N+](=O)[O-])/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-])O

InChI

InChI=1S/C12H8N4O7.C5H11N/c17-9-4-2-7(15(20)21)5-6(9)1-3-8-10(16(22)23)11(18)14-12(19)13-8;1-2-4-6-5-3-1/h1-5,17H,(H2,13,14,18,19);6H,1-5H2/b3-1+;