Chem
J-GLOBAL ID：201507002551839460   Nikkaji number：J3.454.778E

3-(4-(Piperazinomethyl)phenyl)-5-methylisoquinoline-1(2H)-one

3-(4-(ピペラジノメチル)フェニル)-5-メチルイソキノリン-1(2H)-オン
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： C21H23N3O
Molecular formula furigana： C21-H23-N3-O
Molecular weight： 333.435
InChI： InChI=1S/C21H23N3O/c1-15-3-2-4-18-19(15)13-20(23-21(18)25)17-7-5-16(6-8-17)14-24-11-9-22-10-12-24/h2-8,13,22H,9-12,14H2,1H3,(H,23,25)
InChI key： ZZCWXOKQTXSKMI-UHFFFAOYSA-N
SMILES： Cc1cccc2c1cc([nH]c2=O)c1ccc(CN2CCNCC2)cc1
Systematic name  (3)：
  • 3-(4-(ピペラジノメチル)フェニル)-5-メチルイソキノリン-1(2H)-オン
  • 5-メチル-3-{4-[(ピペラジン-1-イル)メチル]フェニル}-1,2-ジヒドロイソキノリン-1-オン
  • 5-methyl-3-{4-[(piperazin-1-yl)methyl]phenyl}-1,2-dihydroisoquinolin-1-one
Other name (1)：
  • 3-(4-(Piperazinomethyl)phenyl)-5-methylisoquinoline-1(2H)-one
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