Chem
J-GLOBAL ID：200907089803128961   Nikkaji number：J2.703.742I

1-Tosyl-4-[3-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-yl]butyl isocyanide

1-トシル-4-[3-メトキシビシクロ[4.2.0]オクタ-1(6),2,4-トリエン-7-イル]ブチルイソシアニド
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： C20[C-]H23[N+]O3S
Molecular formula furigana： C21-H23-N-O3-S
Molecular weight： 369.480
InChI： InChI=1S/C21H23NO3S/c1-15-7-10-19(11-8-15)26(23,24)21(22-2)6-4-5-16-13-17-14-18(25-3)9-12-20(16)17/h7-12,14,16,21H,4-6,13H2,1,3H3
InChI key： BQDCJLYZKDZJQU-UHFFFAOYSA-N
SMILES： COc1ccc2C(CCCC([N+]#[C-])S(=O)(=O)c3ccc(C)cc3)Cc2c1
Systematic name  (3)：
  • 1-トシル-4-[3-メトキシビシクロ[4.2.0]オクタ-1(6),2,4-トリエン-7-イル]ブチルイソシアニド
  • 7-[4-イソシアノ-4-(4-メチルベンゼンスルホニル)ブチル]-3-メトキシビシクロ[4.2.0]オクタ-1,3,5-トリエン
  • 7-[4-isocyano-4-(4-methylbenzenesulfonyl)butyl]-3-methoxybicyclo[4.2.0]octa-1,3,5-triene
Other name (1)：
  • 1-Tosyl-4-[3-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-yl]butyl isocyanide
Thsaurus map：
Thesaurus Map

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