1,4-bis(5-nitro-2-oxidanyl-phenyl)piperazin-2-one

Systemtic Name: 1,4-bis(5-nitro-2-oxidanyl-phenyl)piperazin-2-one Openeye Name: 1,4-bis(2-hydroxy-5-nitro-phenyl)piperazin-2-one CAS Name: 1,4-bis(2-hydroxy-5-nitrophenyl)-2-piperazinone IUPAC Name: 1,4-bis(2-hydroxy-5-nitrophenyl)piperazin-2-one Traditional Name: 1,4-bis(2-hydroxy-5-nitro-phenyl)piperazin-2-one Formula: C16H14N4O7 MolecularWeight: 374.30496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])O)C3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CN(C(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])O)C3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H14N4O7/c21-14-3-1-10(19(24)25)7-12(14)17-5-6-18(16(23)9-17)13-8-11(20(26)27)2-4-15(13)22/h1-4,7-8,21-22H,5-6,9H2