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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Found 233 results

Search term: C22H20BrN5O4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3497258
InChI=1/C22H20BrN5O4/c1-26-19-18(20(29)27(2)22(26)30)28(11-14-5-3-4-6-15(14)23)21(25-19)24-10-13-7-8-16-17(9-13)32-12-31-16/h3-9H,10-12H2,1-2H3,(H,24,25)
C22H20BrN5O4498.329312800
2911115
InChI=1/C22H20BrN5O4/c1-26-19-18(20(29)27(2)22(26)30)28(11-14-4-3-5-15(23)8-14)21(25-19)24-10-13-6-7-16-17(9-13)32-12-31-16/h3-9H,10-12H2,1-2H3,(H,24,25)
C22H20BrN5O4498.329311700
2530206
InChI=1/C22H20BrN5O4/c1-26-19-18(20(29)27(2)22(26)30)28(11-13-3-6-15(23)7-4-13)21(25-19)24-10-14-5-8-16-17(9-14)32-12-31-16/h3-9H,10-12H2,1-2H3,(H,24,25)
C22H20BrN5O4498.329310600
20266329

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20BrN5O4/c1-12-17(20(29)25-15-6-4-5-7-16(15)31-2)18(13-8-10-14(23)11-9-13)28-22(24-12)26-19(27-28)21(30)32-3/h4-11,18H,1-3H3,(H,25,29)(H,24,26,27)
C22H20BrN5O4498.32939700
20266340

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20BrN5O4/c1-12-17(20(29)25-15-9-4-5-10-16(15)31-2)18(13-7-6-8-14(23)11-13)28-22(24-12)26-19(27-28)21(30)32-3/h4-11,18H,1-3H3,(H,25,29)(H,24,26,27)
C22H20BrN5O4498.32939700
27305226
InChI=1/C22H20BrN5O4/c1-31-19-8-3-14(9-20(19)32-2)11-24-21(29)12-27-22(30)18-10-17(26-28(18)13-25-27)15-4-6-16(23)7-5-15/h3-10,13H,11-12H2,1-2H3,(H,24,29)
C22H20BrN5O4498.32939800
27305223
InChI=1/C22H20BrN5O4/c1-31-19-5-3-4-15(21(19)32-2)11-24-20(29)12-27-22(30)18-10-17(26-28(18)13-25-27)14-6-8-16(23)9-7-14/h3-10,13H,11-12H2,1-2H3,(H,24,29)
C22H20BrN5O4498.32938700
20329449
InChI=1/C22H20BrN5O4/c1-31-17-6-3-14(4-7-17)18-10-19-22(30)27(25-13-28(19)26-18)12-21(29)24-11-15-9-16(23)5-8-20(15)32-2/h3-10,13H,11-12H2,1-2H3,(H,24,29)
C22H20BrN5O4498.32938600
20387463
InChI=1/C22H20BrN5O4/c1-13-18(12-28(26-13)16-6-4-15(23)5-7-16)20-25-22(32-27-20)21(29)24-11-14-10-17(30-2)8-9-19(14)31-3/h4-10,12H,11H2,1-3H3,(H,24,29)
C22H20BrN5O4498.32938700
8521248

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20BrN5O4/c1-27-20-13(10-28(22(27)30)17-5-3-2-4-16(17)23)9-24-21(26-20)25-14-6-7-18-19(8-14)31-12-15(11-29)32-18/h2-9,15,29H,10-12H2,1H3,(H,24,25,26)
C22H20BrN5O4498.32936700
22902162

Double-bond stereo
InChI=1/C22H20BrN5O4/c23-15-5-6-18-17(11-15)14(12-24-18)13-25-27-21(30)20(29)26-19-4-2-1-3-16(19)22(31)28-7-9-32-10-8-28/h1-6,11-13,24H,7-10H2,(H,26,29)(H,27,30)/b25-13+
C22H20BrN5O4498.32935400
31801796
InChI=1/C22H20BrN5O4/c23-16-6-11-20(25-14-16)27-22(30)15-3-1-4-18(13-15)26-21(29)5-2-12-24-17-7-9-19(10-8-17)28(31)32/h1,3-4,6-11,13-14,24H,2,5,12H2,(H,26,29)(H,25,27,30)
C22H20BrN5O4498.32934400
5237073

Double-bond stereo
InChI=1/C22H20BrN5O4/c23-15-5-6-18-17(11-15)14(12-24-18)13-25-27-21(30)20(29)26-19-4-2-1-3-16(19)22(31)28-7-9-32-10-8-28/h1-6,11-13,25H,7-10H2,(H,26,29)(H,27,30)
C22H20BrN5O4498.32933200
22011260
InChI=1/C22H20BrN5O4/c1-13-4-8-15(9-5-13)32-16-10-6-14(7-11-16)24-17(29)12-28-19-18(25-21(28)23)20(30)27(3)22(31)26(19)2/h4-11H,12H2,1-3H3,(H,24,29)
C22H20BrN5O4498.32932100
58474425
InChI=1/C22H20BrN5O4/c1-30-15-5-3-14(4-6-15)21-26-25-19-9-10-20(27-28(19)21)32-12-11-24-22(29)17-13-16(31-2)7-8-18(17)23/h3-10,13H,11-12H2,1-2H3,(H,24,29)
C22H20BrN5O4498.32932200
65986752
InChI=1/C22H20BrN5O4/c1-14(29)25-17-4-2-5-18(12-17)27-22(31)28-21-19(6-3-11-24-21)32-13-20(30)26-16-9-7-15(23)8-10-16/h2-12H,13H2,1H3,(H,25,29)(H,26,30)(H2,24,27,28,31)
C22H20BrN5O4498.32932100
65986776
InChI=1/C22H20BrN5O4/c1-14(29)25-16-8-10-18(11-9-16)27-22(31)28-21-19(3-2-12-24-21)32-13-20(30)26-17-6-4-15(23)5-7-17/h2-12H,13H2,1H3,(H,25,29)(H,26,30)(H2,24,27,28,31)
C22H20BrN5O4498.32932100
66412900
InChI=1/C22H20BrN5O4/c23-15-3-1-2-14(10-15)17-12-20(29)26-21(25-17)27-6-8-28(9-7-27)22(30)24-16-4-5-18-19(11-16)32-13-31-18/h1-5,10-12H,6-9,13H2,(H,24,30)(H,25,26,29)
C22H20BrN5O4498.32932100
66412971
InChI=1/C22H20BrN5O4/c23-15-3-1-14(2-4-15)17-12-20(29)26-21(25-17)27-7-9-28(10-8-27)22(30)24-16-5-6-18-19(11-16)32-13-31-18/h1-6,11-12H,7-10,13H2,(H,24,30)(H,25,26,29)
C22H20BrN5O4498.32932100
23996847
InChI=1/C22H20BrN5O4/c23-15-7-5-14(6-8-15)22(32)28-11-9-13(10-12-28)19(29)25-27-21(31)18-16-3-1-2-4-17(16)20(30)26-24-18/h1-8,13H,9-12H2,(H,25,29)(H,26,30)(H,27,31)
C22H20BrN5O4498.32932200
12345

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