Chem
J-GLOBAL ID:200907083003973126   Nikkaji number:J2.213.496E

2-Oxo-4β-piperonyl-1-(4-methoxyphenyl)azetidine-3β-carbonitrile

2-オキソ-4β-ピペロニル-1-(4-メトキシフェニル)アゼチジン-3β-カルボニトリル
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: C19H16N2O4
Molecular formula furigana: C19-H16-N2-O4
Molecular weight: 336.347
InChI: InChI=1S/C19H16N2O4/c1-23-14-5-3-13(4-6-14)21-16(15(10-20)19(21)22)8-12-2-7-17-18(9-12)25-11-24-17/h2-7,9,15-16H,8,11H2,1H3/t15-,16+/m0/s1
InChI key: JTTRGGQSIJHNDP-JKSUJKDBSA-N
SMILES: COc1ccc(cc1)N1[C@H](Cc2ccc3OCOc3c2)[C@H](C#N)C1=O
Systematic name  (3):
  • 2-オキソ-4β-ピペロニル-1-(4-メトキシフェニル)アゼチジン-3β-カルボニトリル
  • (2R,3R)-2-[(2H-1,3-ベンゾジオキソール-5-イル)メチル]-1-(4-メトキシフェニル)-4-オキソアゼチジン-3-カルボニトリル
  • (2R,3R)-2-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxyphenyl)-4-oxoazetidine-3-carbonitrile
Other name (1):
  • 2-Oxo-4β-piperonyl-1-(4-methoxyphenyl)azetidine-3β-carbonitrile
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