5-nitro-2-piperazin-1-yl-benzenesulfonic acid

Systemtic Name: 5-nitro-2-piperazin-1-yl-benzenesulfonic acid Openeye Name: 5-nitro-2-piperazin-1-yl-benzenesulfonic acid CAS Name: 5-nitro-2-(1-piperazinyl)benzenesulfonic acid IUPAC Name: 5-nitro-2-piperazin-1-ylbenzenesulfonic acid Traditional Name: 5-nitro-2-piperazino-besylic acid Formula: C10H13N3O5S MolecularWeight: 287.29232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C10H13N3O5S/c14-13(15)8-1-2-9(10(7-8)19(16,17)18)12-5-3-11-4-6-12/h1-2,7,11H,3-6H2,(H,16,17,18)