Basic Information |
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Product Name: | 3-BENZYL-1H-PURINE-2,6(3H,7H)-DIONE |
CAS: | 19844-93-0 |
English Synonyms: | 3-BENZYL-3,7-DIHYDRO-PURINE-2,6-DIONE ; 3-BENZYL XANTHINE ; 3-BENZYL-1H-PURINE-2,6(3H,7H)-DIONE |
MDL Number.: | MFCD02167630 |
H bond acceptor: | 6 |
H bond donor: | 2 |
Smile: | c1ccc(cc1)Cn2c3c(c(=O)[nH]c2=O)[nH]cn3 |
InChi: | InChI=1S/C12H10N4O2/c17-11-9-10(14-7-13-9)16(12(18)15-11)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14)(H,15,17,18) |
InChiKey: | InChIKey=YWCSDTAKJJLSPO-UHFFFAOYSA-N |
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