Chem
J-GLOBAL ID：200907096276088944   Nikkaji number：J1.597.909G

2-[2-[(1-Naphthyl)sulfonylamino]propionyl]-4-bromo-1,2-dihydroisoquinoline-1-acetic acid benzyl ester

2-[2-[(1-ナフチル)スルホニルアミノ]プロピオニル]-4-ブロモ-1,2-ジヒドロイソキノリン-1-酢酸ベンジル
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： C31H27BrN2O5S
Molecular formula furigana： C31-H27-BR-N2-O5-S
Molecular weight： 619.530
InChI： InChI=1S/C31H27BrN2O5S/c1-21(33-40(37,38)29-17-9-13-23-12-5-6-14-24(23)29)31(36)34-19-27(32)25-15-7-8-16-26(25)28(34)18-30(35)39-20-22-10-3-2-4-11-22/h2-17,19,21,28,33H,18,20H2,1H3
InChI key： YWRQQDHEXIMBNV-UHFFFAOYSA-N
SMILES： CC(NS(=O)(=O)c1cccc2ccccc12)C(=O)N1C=C(Br)c2ccccc2C1CC(=O)OCc1ccccc1
Systematic name  (3)：
  • 2-[2-[(1-ナフチル)スルホニルアミノ]プロピオニル]-4-ブロモ-1,2-ジヒドロイソキノリン-1-酢酸ベンジル
  • ベンジル 2-{4-ブロモ-2-[2-(ナフタレン-1-スルホンアミド)プロパノイル]-1,2-ジヒドロイソキノリン-1-イル}アセタート
  • benzyl 2-{4-bromo-2-[2-(naphthalene-1-sulfonamido)propanoyl]-1,2-dihydroisoquinolin-1-yl}acetate
Other name (1)：
  • 2-[2-[(1-Naphthyl)sulfonylamino]propionyl]-4-bromo-1,2-dihydroisoquinoline-1-acetic acid benzyl ester
Thsaurus map：
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