Chem
J-GLOBAL ID：200907006080591398   Nikkaji number：J1.674.699A

1′,3′,3′-Trimethyl-6-nitro-8-[(1,4,7,10-tetraoxacyclododecane-2-yl)methoxymethyl]spiro[2H-1-benzopyran-2,2′(3′H)-[1H]indole]

1',3',3'-トリメチル-6-ニトロ-8-{[(1,4,7,10-テトラオキサシクロドデカン-2-イル)メトキシ]メチル}-1',3'-ジヒドロスピロ[クロメン-2,2'-インドール]
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： C29H36N[N+]O7[O-]
Molecular formula furigana： C29-H36-N2-O8
Molecular weight： 540.613
InChI： InChI=1S/C29H36N2O8/c1-28(2)25-6-4-5-7-26(25)30(3)29(28)9-8-21-16-23(31(32)33)17-22(27(21)39-29)18-37-20-24-19-36-13-12-34-10-11-35-14-15-38-24/h4-9,16-17,24H,10-15,18-20H2,1-3H3
InChI key： QLCPXDMWFYEBHV-UHFFFAOYSA-N
SMILES： CN1c2ccccc2C(C)(C)C21Oc1c(COCC3COCCOCCOCCO3)cc(cc1C=C2)[N+](=O)[O-]
Systematic name  (4)：
  • 1′,3′,3′-トリメチル-6-ニトロ-8-[(1,4,7,10-テトラオキサシクロドデカン-2-イルメトキシ)メチル]-1′,3′-ジヒドロスピロ[2H-1-ベンゾピラン-2,2′-[2H]インドール]
  • 1′,3′,3′-トリメチル-6-ニトロ-8-[(1,4,7,10-テトラオキサシクロドデカン-2-イル)メトキシメチル]スピロ[2H-1-ベンゾピラン-2,2′(3′H)-[1H]インドール]
  • 1',3',3'-トリメチル-6-ニトロ-8-{[(1,4,7,10-テトラオキサシクロドデカン-2-イル)メトキシ]メチル}-1',3'-ジヒドロスピロ[クロメン-2,2'-インドール]
  • 1',3',3'-trimethyl-6-nitro-8-{[(1,4,7,10-tetraoxacyclododecan-2-yl)methoxy]methyl}-1',3'-dihydrospiro[chromene-2,2'-indole]
Other name (2)：
  • 1′,3′,3′-Trimethyl-6-nitro-8-[(1,4,7,10-tetraoxacyclododecane-2-ylmethoxy)methyl]-1′,3′-dihydrospiro[2H-1-benzopyran-2,2′-[2H]indole]
  • 1′,3′,3′-Trimethyl-6-nitro-8-[(1,4,7,10-tetraoxacyclododecane-2-yl)methoxymethyl]spiro[2H-1-benzopyran-2,2′(3′H)-[1H]indole]
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