Chem
J-GLOBAL ID：201907005103498901   Nikkaji number：J3.734.907K

4-[6-carbamoyl-9-(4-methoxyphenyl)-8-oxo-7H-purin-2-yl]benzoic acid

4-[6-カルバモイル-9-(4-メトキシフェニル)-8-オキソ-7H-プリン-2-イル]安息香酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H15N5O5
Molecular formula furigana： C20-H15-N5-O5
Molecular weight： 405.370
InChI： InChI=1S/C20H15N5O5/c1-30-13-8-6-12(7-9-13)25-18-15(23-20(25)29)14(16(21)26)22-17(24-18)10-2-4-11(5-3-10)19(27)28/h2-9H,1H3,(H2,21,26)(H,23,29)(H,27,28)
InChI key： SFLUTGMXKMXULQ-UHFFFAOYSA-N
SMILES： c1(C(=O)O)ccc(cc1)c1nc(c2[nH]c(=O)n(c2n1)c1ccc(cc1)OC)C(=O)N
Systematic name  (3)：
  • 4-[6-カルバモイル-7,8-ジヒドロ-9-(4-メトキシフェニル)-8-オキソ-9H-プリン-2-イル]安息香酸
  • 4-[6-カルバモイル-9-(4-メトキシフェニル)-8-オキソ-8,9-ジヒドロ-7H-プリン-2-イル]安息香酸
  • 4-[6-carbamoyl-9-(4-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-2-yl]benzoic acid
Other name (2)：
  • 4-[6-カルバモイル-9-(4-メトキシフェニル)-8-オキソ-7H-プリン-2-イル]安息香酸
  • 4-[6-carbamoyl-9-(4-methoxyphenyl)-8-oxo-7H-purin-2-yl]benzoic acid
Thsaurus map：
Thesaurus Map

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