Chem
J-GLOBAL ID:200907029882830843
Nikkaji number:J2.486.011F
1-Tosyl-3-[3-(ethoxycarbonyl)phenyl]-5-methoxy-1H-indazole
1-トシル-3-[3-(エトキシカルボニル)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:
C24 H22 N2 O5 S
Molecular formula furigana:
C24-H22-N2-O5-S
Molecular weight:
450.510
InChI:
InChI=1S/C24H22N2O5S/c1-4-31-24(27)18-7-5-6-17(14-18)23-21-15-19(30-3)10-13-22(21)26(25-23)32(28,29)20-11-8-16(2)9-12-20/h5-15H,4H2,1-3H3
InChI key:
VSYSOQOIXDEXBF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1)c1nn(c2ccc(OC)cc12)S(=O)(=O)c1ccc(C)cc1
Systematic name (3):
1-トシル-3-[3-(エトキシカルボニル)フェニル]-5-メトキシ-1H-インダゾール
エチル 3-[5-メトキシ-1-(4-メチルベンゼンスルホニル)-1H-インダゾール-3-イル]ベンゾアート
ethyl 3-[5-methoxy-1-(4-methylbenzenesulfonyl)-1H-indazol-3-yl]benzoate
Other name (1):
1-Tosyl-3-[3-(ethoxycarbonyl)phenyl]-5-methoxy-1H-indazole
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