Chem
J-GLOBAL ID：200907074735083892   Nikkaji number：J533.366K

(3E)-2-[(Methylsulfonyl)imino]-4-[2-(3-phenyl-2-propynyloxy)phenyl]-3-butenoic acid ethyl ester

(3E)-2-[(メチルスルホニル)イミノ]-4-[2-(3-フェニル-2-プロピニルオキシ)フェニル]-3-ブテン酸エチル
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： C22H21NO5S
Molecular formula furigana： C22-H21-N-O5-S
Molecular weight： 411.470
InChI： InChI=1S/C22H21NO5S/c1-3-27-22(24)20(23-29(2,25)26)16-15-19-13-7-8-14-21(19)28-17-9-12-18-10-5-4-6-11-18/h4-8,10-11,13-16H,3,17H2,1-2H3/b16-15+,23-20?
InChI key： HDMDOMITVDSRNI-VQVHYFGVSA-N
SMILES： CCOC(=O)C(=NS(=O)(=O)C)/C=C/c1ccccc1OCC#Cc1ccccc1
Systematic name  (3)：
  • (3E)-2-[(メチルスルホニル)イミノ]-4-[2-(3-フェニル-2-プロピニルオキシ)フェニル]-3-ブテン酸エチル
  • エチル (3E)-2-(メタンスルホニルイミノ)-4-{2-[(3-フェニルプロパ-2-イン-1-イル)オキシ]フェニル}ブタ-3-エノアート
  • ethyl (3E)-2-(methanesulfonylimino)-4-{2-[(3-phenylprop-2-yn-1-yl)oxy]phenyl}but-3-enoate
Other name (1)：
  • (3E)-2-[(Methylsulfonyl)imino]-4-[2-(3-phenyl-2-propynyloxy)phenyl]-3-butenoic acid ethyl ester
Thsaurus map：
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