Chem
J-GLOBAL ID：201407046309709829   Nikkaji number：J3.250.250D

2,3-[1,3]Butadieno-6,7-(iminopropano)-4,5-dihydrooxepin-8,10-diene-9-carbonitrile

2,3-[1,3]ブタジエノ-6,7-(イミノプロパノ)-4,5-ジヒドロオキセピン-8,10-ジエン-9-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： C14H10N2O
Molecular formula furigana： C14-H10-N2-O
Molecular weight： 222.247
InChI： InChI=1S/C14H10N2O/c15-8-10-7-14-12(16-9-10)6-5-11-3-1-2-4-13(11)17-14/h1-4,7,9H,5-6H2
InChI key： BQMDGPZVIRXJTO-UHFFFAOYSA-N
SMILES： N#Cc1cnc2CCc3ccccc3Oc2c1
Systematic name  (3)：
  • 2,3-[1,3]ブタジエノ-6,7-(イミノプロパノ)-4,5-ジヒドロオキセピン-8,10-ジエン-9-カルボニトリル
  • 2-オキサ-7-アザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-5-カルボニトリル
  • 2-oxa-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-5-carbonitrile
Other name (1)：
  • 2,3-[1,3]Butadieno-6,7-(iminopropano)-4,5-dihydrooxepin-8,10-diene-9-carbonitrile
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