3-{(2E)-2-[(2E)-2-(3,5-Dinitro-6-oxo-2,4-cyclohexadien-1-ylidene)ethylidene]-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl}propanoic acid - N,N-dimethylformamide (1:2)

More details:

• Systematic name

  3-{(2E)-2-[(2E)-2-(3,5-Dinitro-6-oxo-2,4-cyclohexadien-1-ylidene)ethylidene]-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl}propanoic acid - N,N-dimethylformamide (1:2)

• SMILES

  CC\1(c2ccccc2N(/C1=C/C=C/3\C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-])CCC(=O)O)C.CN(C)C=O.CN(C)C=O

• Std. InChi

  InChI=1S/C21H19N3O7.2C3H7NO/c1-21(2)15-5-3-4-6-16(15)22(10-9-19(25)26)18(21)8-7-13-11-14(23(28)29)12-17(20(13)27)24(30)31;2*1-4(2)3-5/h3-8,11-12H,9-10H2,1-2H3,(H,25,26);2*3H,1-2H3/b13-7+,18-8+;;

• Std. InChIKey

  PXRBDLNVZLPLPO-TXWHWSIYSA-N

• Cite this record

  CSID:21175065, http://www.chemspider.com/Chemical-Structure.21175065.html (accessed 23:47, Jun 8, 2024)