4-(3-nitro-4-oxidanyl-phenyl)sulfonylpiperazin-2-one

Systemtic Name: 4-(3-nitro-4-oxidanyl-phenyl)sulfonylpiperazin-2-one Openeye Name: 4-(4-hydroxy-3-nitro-phenyl)sulfonylpiperazin-2-one CAS Name: 4-(4-hydroxy-3-nitrophenyl)sulfonyl-2-piperazinone IUPAC Name: 4-(4-hydroxy-3-nitrophenyl)sulfonylpiperazin-2-one Traditional Name: 4-(4-hydroxy-3-nitro-phenyl)sulfonylpiperazin-2-one Formula: C10H11N3O6S MolecularWeight: 301.27584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O6S/c14-9-2-1-7(5-8(9)13(16)17)20(18,19)12-4-3-11-10(15)6-12/h1-2,5,14H,3-4,6H2,(H,11,15)