acetonitrile; 2-[2-(2-carboxy-6-methyl-phenyl)-1,3,5,7-tetraoxo-pyrrolo[3,4-f]isoindol-6-yl]-3-methyl-benzoic acid; ethyl 2-(6-aminopurin-9-yl)acetate

More details:

• Systematic name

  acetonitrile; 2-[2-(2-carboxy-6-methyl-phenyl)-1,3,5,7-tetraoxo-pyrrolo[3,4-f]isoindol-6-yl]-3-methyl-benzoic acid; ethyl 2-(6-aminopurin-9-yl)acetate

• SMILES

  CCOC(=O)Cn1cnc2c1ncnc2N.CC#N.CC#N.Cc1cccc(c1n2c(=O)c3cc4c(cc3c2=O)c(=O)n(c4=O)c5c(cccc5C(=O)O)C)C(=O)O

• Std. InChi

  InChI=1S/C26H16N2O8.C9H11N5O2.2C2H3N/c1-11-5-3-7-13(25(33)34)19(11)27-21(29)15-9-17-18(10-16(15)22(27)30)24(32)28(23(17)31)20-12(2)6-4-8-14(20)26(35)36;1-2-16-6(15)3-14-5-13-7-8(10)11-4-12-9(7)14;2*1-2-3/h3-10H,1-2H3,(H,33,34)(H,35,36);4-5H,2-3H2,1H3,(H2,10,11,12);2*1H3

• Std. InChIKey

  OGPIIQBFMOSAFL-UHFFFAOYSA-N

• Cite this record

  CSID:21157008, http://www.chemspider.com/Chemical-Structure.21157008.html (accessed 06:41, Jun 3, 2024)