1-[[3-(4-CHLOROPHENYL)-1,2,4-OXADIAZOL-5-YL]METHYL]-1-(4-CYANOBENZYL)HEXAHYDROPYRIDINIUM BROMIDE

CAS No.
646497-36-1
CCD No.
CCD00095707
Formula
C22 H22 Cl N4 O . Br
MolWeight
473.8

Basic Information

Product Name: 1-[[3-(4-CHLOROPHENYL)-1,2,4-OXADIAZOL-5-YL]METHYL]-1-(4-CYANOBENZYL)HEXAHYDROPYRIDINIUM BROMIDE
CAS: 646497-36-1
English Synonyms: 1-[[3-(4-CHLOROPHENYL)-1,2,4-OXADIAZOL-5-YL]METHYL]-1-(4-CYANOBENZYL)HEXAHYDROPYRIDINIUM BROMIDE
MDL Number.: MFCD00206156
H bond acceptor: 5
H bond donor: 0
Smile: c1cc(ccc1C[N+]2(CCCCC2)Cc3nc(no3)c4ccc(cc4)Cl)C#N.[Br-]
InChi: InChI=1S/C22H22ClN4O.BrH/c23-20-10-8-19(9-11-20)22-25-21(28-26-22)16-27(12-2-1-3-13-27)15-18-6-4-17(14-24)5-7-18;/h4-11H,1-3,12-13,15-16H2;1H/q+1;/p-1
InChiKey: InChIKey=JGHBOWYUZXUHSR-UHFFFAOYSA-M

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