Chem
J-GLOBAL ID:200907034771128973   Nikkaji number:J2.757.029A

1,7-[Carbonyl[(methylsulfonyloxy)methylene]]-5-[(E)-2-(methoxycarbonyl)-2-methoxyethenyl]-1-azaspiro[5.5]undeca-4,8-diene-4,7-dicarboxylic acid dimethyl ester

1,7-[カルボニル[(メチルスルホニルオキシ)メチレン]]-5-[(E)-2-(メトキシカルボニル)-2-メトキシエテニル]-1-アザスピロ[5.5]ウンデカ-4,8-ジエン-4,7-ジカルボン酸ジメチル
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: C22H27NO11S
Molecular formula furigana: C22-H27-N-O11-S
Molecular weight: 513.510
InChI: InChI=1S/C22H27NO11S/c1-30-15(19(26)32-3)12-14-13(18(25)31-2)8-11-23-17(24)16(34-35(5,28)29)21(20(27)33-4)9-6-7-10-22(14,21)23/h6,9,12,16H,7-8,10-11H2,1-5H3/b15-12+
InChI key: ZPJCTHIMERYRKY-NTCAYCPXSA-N
SMILES: COC(=O)/C(=C\C1=C(CCN2C(=O)C(OS(=O)(=O)C)C3(C=CCCC123)C(=O)OC)C(=O)OC)/OC
Systematic name  (3):
  • 1,7-[カルボニル[(メチルスルホニルオキシ)メチレン]]-5-[(E)-2-(メトキシカルボニル)-2-メトキシエテニル]-1-アザスピロ[5.5]ウンデカ-4,8-ジエン-4,7-ジカルボン酸ジメチル
  • 2,7a-ジメチル 1-[(1E)-2,3-ジメトキシ-3-オキソプロパ-1-エン-1-イル]-7-(メタンスルホニルオキシ)-6-オキソ-3H,4H,6H,7H,7aH,10H,11H-ピリド[2,1-r269234]インドール-2,7a-ジカルボキシラート
  • 2,7a-dimethyl 1-[(1E)-2,3-dimethoxy-3-oxoprop-1-en-1-yl]-7-(methanesulfonyloxy)-6-oxo-3H,4H,6H,7H,7aH,10H,11H-pyrido[2,1-r269234]indole-2,7a-dicarboxylate
Other name (1):
  • 1,7-[Carbonyl[(methylsulfonyloxy)methylene]]-5-[(E)-2-(methoxycarbonyl)-2-methoxyethenyl]-1-azaspiro[5.5]undeca-4,8-diene-4,7-dicarboxylic acid dimethyl ester
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