methyl 3-(4-methylbenzoyl)-2-(3-nitrophenyl)-1,5,7,8,9-pentazabicyclo[4.3.0]nona-3,5,7-triene-4-carboxylate

Molecular Formula: C20H16N6O5


InChI: InChI=1/C20H16N6O5/c1-11-6-8-12(9-7-11)18(27)15-16(19(28)31-2)21-20-22-23-24-25(20)17(15)13-4-3-5-14(10-13)26(29)30/h3-10,17H,1-2H3,(H,21,22,24)/f/h24H

InChIKey: InChIKey=UQAQLAQBPCEFLU-LQFNOIFHCV
SMILES: CC1=CC=C(C=C1)C(=O)C2=C(N=C3N=NNN3C2C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Names:
    methyl 3-(4-methylbenzoyl)-2-(3-nitrophenyl)-1,5,7,8,9-pentazabicyclo[4.3.0]nona-3,5,7-triene-4-carboxylate

Registries:
    PubChem CID 6014999
    PubChem ID 6050525