Chem
J-GLOBAL ID：201407021038080757   Nikkaji number：J3.250.248B

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

4-ヘキシル-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： C20H22N2O
Molecular formula furigana： C20-H22-N2-O
Molecular weight： 306.409
InChI： InChI=1S/C20H22N2O/c1-2-3-4-5-8-16-12-18-20(11-15(13-21)14-22-18)23-19-10-7-6-9-17(16)19/h6-7,9-11,14,16H,2-5,8,12H2,1H3
InChI key： CCFBYTRJJGBQDP-UHFFFAOYSA-N
SMILES： CCCCCCC1Cc2ncc(cc2Oc2ccccc12)C#N
Systematic name  (3)：
  • 4-ヘキシル-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
  • 10-ヘキシル-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
  • 10-hexyl-2-oxa-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-5-carbonitrile
Other name (1)：
  • 4-Hexyl-2,3-[1,3]butadieno-6,7-(iminopropano)-4,5-dihydrooxepin-8,10-diene-9-carbonitrile
Thsaurus map：
Thesaurus Map

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