Chem
J-GLOBAL ID:200907015679669246
Nikkaji number:J1.232.578I
3-Methyl-4-butyl-5-(acetoxymethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
3-メチル-4-ブチル-5-(アセトキシメチル)-1H-ピロール-2-カルボン酸tert-ブチル
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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:
C17 H27 NO4
Molecular formula furigana:
C17-H27-N-O4
Molecular weight:
309.406
InChI:
InChI=1S/C17H27NO4/c1-7-8-9-13-11(2)15(16(20)22-17(4,5)6)18-14(13)10-21-12(3)19/h18H,7-10H2,1-6H3
InChI key:
MUBJAEMTNOLHGZ-UHFFFAOYSA-N
SMILES:
CCCCc1c(C)c([nH]c1COC(=O)C)C(=O)OC(C)(C)C
Systematic name (3):
3-メチル-4-ブチル-5-(アセトキシメチル)-1H-ピロール-2-カルボン酸tert-ブチル
tert-ブチル 5-[(アセチルオキシ)メチル]-4-ブチル-3-メチル-1H-ピロール-2-カルボキシラート
tert-butyl 5-[(acetyloxy)methyl]-4-butyl-3-methyl-1H-pyrrole-2-carboxylate
Other name (1):
3-Methyl-4-butyl-5-(acetoxymethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
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