Chem
J-GLOBAL ID:200907092860887942
Nikkaji number:J2.328.905I
4-Chloro-1H-indole-3-acetic acid (S)-1-methyl-2-oxo-2-ethoxyethyl ester
4-クロロ-1H-インドール-3-酢酸(S)-1-メチル-2-オキソ-2-エトキシエチル
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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 ClNO4
Molecular formula furigana:
C15-H16-CL-N-O4
Molecular weight:
309.750
InChI:
InChI=1S/C15H16ClNO4/c1-3-20-15(19)9(2)21-13(18)7-10-8-17-12-6-4-5-11(16)14(10)12/h4-6,8-9,17H,3,7H2,1-2H3/t9-/m0/s1
InChI key:
VQILUTSXBZDXQW-VIFPVBQESA-N
SMILES:
CCOC(=O)[C@H](C)OC(=O)Cc1c[nH]c2cccc(Cl)c12
Systematic name (3):
4-クロロ-1H-インドール-3-酢酸(S)-1-メチル-2-オキソ-2-エトキシエチル
エチル (2S)-2-{[2-(4-クロロ-1H-インドール-3-イル)アセチル]オキシ}プロパノアート
ethyl (2S)-2-{[2-(4-chloro-1H-indol-3-yl)acetyl]oxy}propanoate
Other name (1):
4-Chloro-1H-indole-3-acetic acid (S)-1-methyl-2-oxo-2-ethoxyethyl ester
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