Chem
J-GLOBAL ID:201807018200089096
Nikkaji number:J3.721.468J
1-Phenyl-3-(1-cyano-3-hydroxypropyl)-5-amino-1H-pyrazole-4-carboxylic acid methyl ester
1-フェニル-3-(1-シアノ-3-ヒドロキシプロピル)-5-アミノ-1H-ピラゾール-4-カルボン酸メチル
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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:
C15 H16 N4 O3
Molecular formula furigana:
C15-H16-N4-O3
Molecular weight:
300.318
InChI:
InChI=1S/C15H16N4O3/c1-22-15(21)12-13(10(9-16)7-8-20)18-19(14(12)17)11-5-3-2-4-6-11/h2-6,10,20H,7-8,17H2,1H3
InChI key:
TZXZMYWJVPKANO-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(N)n(nc1C(CCO)C#N)c1ccccc1
Systematic name (3):
1-フェニル-3-(1-シアノ-3-ヒドロキシプロピル)-5-アミノ-1H-ピラゾール-4-カルボン酸メチル
メチル 5-アミノ-3-(1-シアノ-3-ヒドロキシプロピル)-1-フェニル-1H-ピラゾール-4-カルボキシラート
methyl 5-amino-3-(1-cyano-3-hydroxypropyl)-1-phenyl-1H-pyrazole-4-carboxylate
Other name (1):
1-Phenyl-3-(1-cyano-3-hydroxypropyl)-5-amino-1H-pyrazole-4-carboxylic acid methyl ester
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