Chem
J-GLOBAL ID:200907012610650854   Nikkaji number:J1.736.702A

1-[3-Methoxy-4-(benzyloxy)benzyl]-6-(benzyloxy)-7-methoxyisoquinoline

1-[3-メトキシ-4-(ベンジルオキシ)ベンジル]-6-(ベンジルオキシ)-7-メトキシイソキノリン
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: C32H29NO4
Molecular formula furigana: C32-H29-N-O4
Molecular weight: 491.587
InChI: InChI=1S/C32H29NO4/c1-34-30-18-25(13-14-29(30)36-21-23-9-5-3-6-10-23)17-28-27-20-31(35-2)32(19-26(27)15-16-33-28)37-22-24-11-7-4-8-12-24/h3-16,18-20H,17,21-22H2,1-2H3
InChI key: VXNBVVHKSVHUSS-UHFFFAOYSA-N
SMILES: COc1cc(Cc2nccc3cc(OCc4ccccc4)c(OC)cc23)ccc1OCc1ccccc1
Systematic name  (3):
  • 1-[3-メトキシ-4-(ベンジルオキシ)ベンジル]-6-(ベンジルオキシ)-7-メトキシイソキノリン
  • 6-(ベンジルオキシ)-1-{[4-(ベンジルオキシ)-3-メトキシフェニル]メチル}-7-メトキシイソキノリン
  • 6-(benzyloxy)-1-{[4-(benzyloxy)-3-methoxyphenyl]methyl}-7-methoxyisoquinoline
Other name (1):
  • 1-[3-Methoxy-4-(benzyloxy)benzyl]-6-(benzyloxy)-7-methoxyisoquinoline
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