pentan-2-ylcarbamoylmethyl 9,10,10-trioxothioxanthene-3-carboxylate

Molecular Formula: C21H21NO6S


InChI: InChI=1/C21H21NO6S/c1-3-6-13(2)22-19(23)12-28-21(25)14-9-10-16-18(11-14)29(26,27)17-8-5-4-7-15(17)20(16)24/h4-5,7-11,13H,3,6,12H2,1-2H3,(H,22,23)/f/h22H

InChIKey: InChIKey=UWVPDWCXSPQCHT-QWOVJGMICC
SMILES: CCCC(C)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

Names:
    pentan-2-ylcarbamoylmethyl 9,10,10-trioxothioxanthene-3-carboxylate

Registries:
    PubChem CID 4855151
    PubChem ID 9809702