4-[5-(2H-1,3-BENZODIOXOL-5-YL)-2H-1,2,3,4-TETRAZOL-2-YL]BUTANENITRILE

pro_cas
pro_cdbregno
CCD08221908
pro_formula
C12 H11 N5 O2
pro_molWeight
257.252

basic_info

Product_Name: 4-[5-(2H-1,3-BENZODIOXOL-5-YL)-2H-1,2,3,4-TETRAZOL-2-YL]BUTANENITRILE
EnglishSynonyms: 4-[5-(2H-1,3-BENZODIOXOL-5-YL)-2H-1,2,3,4-TETRAZOL-2-YL]BUTANENITRILE
pro_mdlNumber: MFCD09063246
pro_acceptors: 7
pro_donors: 0
pro_smile: c1cc2c(cc1c3nnn(n3)CCCC#N)OCO2
InChi: InChI=1S/C12H11N5O2/c13-5-1-2-6-17-15-12(14-16-17)9-3-4-10-11(7-9)19-8-18-10/h3-4,7H,1-2,6,8H2
InChiKey: InChIKey=CEQLFYWKHZTBCM-UHFFFAOYSA-N

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