[5,5-dimethyl-2-(4-nitrophenyl)sulfanyl-3-oxo-1-cyclohexenyl] 4-bromobenzoate

Molecular Formula: C₂₁H₁₈BrNO₅S

InChI: InChI=1/C21H18BrNO5S/c1-21(2)11-17(24)19(29-16-9-7-15(8-10-16)23(26)27)18(12-21)28-20(25)13-3-5-14(22)6-4-13/h3-10H,11-12H2,1-2H3

InChIKey: InChIKey=IZRNFJFNVDCUTO-UHFFFAOYAP
SMILES: CC1(CC(=C(C(=O)C1)SC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)Br)C

Names:
    [5,5-dimethyl-2-(4-nitrophenyl)sulfanyl-3-oxo-1-cyclohexenyl] 4-bromobenzoate

Registries:
    PubChem CID 2337323
    PubChem ID 4853073