4-(4-bromanyl-3-nitro-phenyl)carbonylpiperazin-2-one

Systemtic Name: 4-(4-bromanyl-3-nitro-phenyl)carbonylpiperazin-2-one Openeye Name: 4-(4-bromo-3-nitro-benzoyl)piperazin-2-one CAS Name: 4-[(4-bromo-3-nitrophenyl)-oxomethyl]-2-piperazinone IUPAC Name: 4-(4-bromo-3-nitrobenzoyl)piperazin-2-one Traditional Name: 4-(4-bromo-3-nitro-benzoyl)piperazin-2-one Formula: C11H10BrN3O4 MolecularWeight: 328.1188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C11H10BrN3O4/c12-8-2-1-7(5-9(8)15(18)19)11(17)14-4-3-13-10(16)6-14/h1-2,5H,3-4,6H2,(H,13,16)