Chem
J-GLOBAL ID:200907001221291626
Nikkaji number:J2.424.578K
2-Methyl-3-[1-phenyl-2-(3-methyl-4-nitro-5-isoxazolyl)ethyl]-5-methoxy-1H-indole
2-メチル-3-[1-フェニル-2-(3-メチル-4-ニトロ-5-イソオキサゾリル)エチル]-5-メトキシ-1H-インドール
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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:
C22 H21 N2 [N+]O3 [O-]
Molecular formula furigana:
C22-H21-N3-O4
Molecular weight:
391.427
InChI:
InChI=1S/C22H21N3O4/c1-13-21(18-11-16(28-3)9-10-19(18)23-13)17(15-7-5-4-6-8-15)12-20-22(25(26)27)14(2)24-29-20/h4-11,17,23H,12H2,1-3H3
InChI key:
WFUKZNRTHRJOIX-UHFFFAOYSA-N
SMILES:
COc1ccc2[nH]c(C)c(C(Cc3onc(C)c3[N+](=O)[O-])c3ccccc3)c2c1
Systematic name (3):
2-メチル-3-[1-フェニル-2-(3-メチル-4-ニトロ-5-イソオキサゾリル)エチル]-5-メトキシ-1H-インドール
5-メトキシ-2-メチル-3-[2-(3-メチル-4-ニトロ-1,2-オキサゾール-5-イル)-1-フェニルエチル]-1H-インドール
5-methoxy-2-methyl-3-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)-1-phenylethyl]-1H-indole
Other name (1):
2-Methyl-3-[1-phenyl-2-(3-methyl-4-nitro-5-isoxazolyl)ethyl]-5-methoxy-1H-indole
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