Chem
J-GLOBAL ID:200907064851744051
Nikkaji number:J2.486.009D
1-Tosyl-3-(3-nitrophenyl)-5-methoxy-1H-indazole
1-トシル-3-(3-ニトロフェニル)-5-メトキシ-1H-インダゾール
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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:
C21 H17 N2 [N+]O4 [O-]S
Molecular formula furigana:
C21-H17-N3-O5-S
Molecular weight:
423.440
InChI:
InChI=1S/C21H17N3O5S/c1-14-6-9-18(10-7-14)30(27,28)23-20-11-8-17(29-2)13-19(20)21(22-23)15-4-3-5-16(12-15)24(25)26/h3-13H,1-2H3
InChI key:
NAXOJUBLRAXQMD-UHFFFAOYSA-N
SMILES:
COc1ccc2n(nc(c3cccc(c3)[N+](=O)[O-])c2c1)S(=O)(=O)c1ccc(C)cc1
Systematic name (3):
1-トシル-3-(3-ニトロフェニル)-5-メトキシ-1H-インダゾール
5-メトキシ-1-(4-メチルベンゼンスルホニル)-3-(3-ニトロフェニル)-1H-インダゾール
5-methoxy-1-(4-methylbenzenesulfonyl)-3-(3-nitrophenyl)-1H-indazole
Other name (1):
1-Tosyl-3-(3-nitrophenyl)-5-methoxy-1H-indazole
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