Chem
J-GLOBAL ID：202007005647905420   Nikkaji number：J3.757.265I

5-(4-メトキシフェニル)-2-ベンゾオキサゾールカルボン酸ヘキシル

5-(4-メトキシフェニル)-2-ベンゾオキサゾールカルボン酸ヘキシル
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： C21H23NO4
Molecular formula furigana： C21-H23-N-O4
Molecular weight： 353.418
InChI： InChI=1S/C21H23NO4/c1-3-4-5-6-13-25-21(23)20-22-18-14-16(9-12-19(18)26-20)15-7-10-17(24-2)11-8-15/h7-12,14H,3-6,13H2,1-2H3
InChI key： AHJPYYSKSBZHMH-UHFFFAOYSA-N
SMILES： c12oc(nc1cc(cc2)c1ccc(cc1)OC)C(=O)OCCCCCC
Systematic name  (3)：
  • 5-(4-メトキシフェニル)-2-ベンゾオキサゾールカルボン酸ヘキシル
  • ヘキシル5-(4-メトキシフェニル)-1,3-ベンゾオキサゾール-2-カルボキシラート
  • hexyl 5-(4-methoxyphenyl)-1,3-benzoxazole-2-carboxylate
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