Chem
J-GLOBAL ID：201407079215767189
Nikkaji number：J3.324.397I
1′-Phenyl-3′-methyl-4-chloro-5′-nitro-6′-(methylamino)spiro[1H-indole-3(2H),4′(1′H)-pyrano[2,3-c]pyrazole]-2-one
1′-フェニル-3′-メチル-4-クロロ-5′-ニトロ-6′-(メチルアミノ)スピロ[1H-インドール-3(2H),4′(1′H)-ピラノ[2,3-c]ピラゾール]-2-オン
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
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
Molecular formula： C21H16ClN4[N+]O3[O-]
Molecular formula furigana： C21-H16-CL-N5-O4
Molecular weight： 437.840
InChI：
InChI=1S/C21H16ClN5O4/c1-11-15-19(26(25-11)12-7-4-3-5-8-12)31-18(23-2)17(27(29)30)21(15)16-13(22)9-6-10-14(16)24-20(21)28/h3-10,23H,1-2H3,(H,24,28)
InChI key：
GOBXXFBWKWBEOD-UHFFFAOYSA-N
SMILES：
CNC1=C([N+](=O)[O-])C2(C(=O)Nc3cccc(Cl)c23)c2c(C)nn(c2O1)c1ccccc1
Systematic name (3)：
- 1′-フェニル-3′-メチル-4-クロロ-5′-ニトロ-6′-(メチルアミノ)スピロ[1H-インドール-3(2H),4′(1′H)-ピラノ[2,3-c]ピラゾール]-2-オン
- 4-クロロ-3'-メチル-6'-(メチルアミノ)-5'-ニトロ-1'-フェニル-1,2-ジヒドロ-1'H-スピロ[インドール-3,4'-ピラノ[2,3-c]ピラゾール]-2-オン
- 4-chloro-3'-methyl-6'-(methylamino)-5'-nitro-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-2-one
- 1′-Phenyl-3′-methyl-4-chloro-5′-nitro-6′-(methylamino)spiro[1H-indole-3(2H),4′(1′H)-pyrano[2,3-c]pyrazole]-2-one
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