4-chloro-2-nitro-8-oxo-7-oxa-9-thiabicyclo[4.3.0]nona-1,3,5-trien-3-olate; cyclohexylazanium

Molecular Formula: C13H15ClN2O5S


InChI: InChI=1/C7H2ClNO5S.C6H13N/c8-2-1-3-6(15-7(11)14-3)4(5(2)10)9(12)13;7-6-4-2-1-3-5-6/h1,10H;6H,1-5,7H2/fC7HClNO5S.C6H14N/h10h;7H/q-1;+1

InChIKey: InChIKey=XOCZOPYIKDQXOM-DOQJMWOPCL
SMILES: C1CCC(CC1)[NH3+].C1=C2C(=C(C(=C1Cl)[O-])[N+](=O)[O-])SC(=O)O2

Names:
    4-chloro-2-nitro-8-oxo-7-oxa-9-thiabicyclo[4.3.0]nona-1,3,5-trien-3-olate; cyclohexylazanium

Registries:
    PubChem CID 2829451
    PubChem ID 11564101