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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 775 results

Search term: C21H32N6O3 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
46451

InChI=1/C21H32N6O3/c1-4-19(28)27(18-9-7-6-8-10-18)21(17-30-3)11-13-24(14-12-21)15-16-26-20(29)25(5-2)22-23-26/h6-10H,4-5,11-17H2,1-3H3
C21H32N6O3416.517258136719704
35308357
InChI=1/C21H32N6O3/c1-14(2)7-8-27-16(22-18-17(27)20(29)24(4)21(30)23(18)3)13-25-9-11-26(12-10-25)19(28)15-5-6-15/h14-15H,5-13H2,1-4H3
C21H32N6O3416.5172353500
109033

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H32N6O3/c1-24-17(13-15-7-3-2-4-8-15)20(30)27-12-6-10-18(27)19(29)26-16(14-28)9-5-11-25-21(22)23/h2-4,7-8,14,16-18,24H,5-6,9-13H2,1H3,(H,26,29)(H4,22,23,25)/t16-,17+,18-/m0/s1
C21H32N6O3416.5172272700
28600183
InChI=1/C21H32N6O3/c1-4-29-18(30-5-2)14-17-19(22)24-21(25-20(17)28)23-15-7-6-8-16(13-15)27-11-9-26(3)10-12-27/h6-8,13,18H,4-5,9-12,14H2,1-3H3,(H4,22,23,24,25,28)
C21H32N6O3416.5172251200
28600217
InChI=1/C21H32N6O3/c1-4-29-18(30-5-2)14-17-19(22)24-21(25-20(17)28)23-15-6-8-16(9-7-15)27-12-10-26(3)11-13-27/h6-9,18H,4-5,10-14H2,1-3H3,(H4,22,23,24,25,28)
C21H32N6O3416.5172251400
4959843
InChI=1/C21H32N6O3/c1-15-16(2)27-17-18(22-20(27)25(15)11-8-14-30-4)23(3)21(29)26(19(17)28)13-12-24-9-6-5-7-10-24/h5-14H2,1-4H3
C21H32N6O3416.5172201300
11123978
InChI=1/C21H32N6O3/c1-23-18-17(19(28)27(21(23)29)11-10-24-12-14-30-15-13-24)26-9-5-8-25(20(26)22-18)16-6-3-2-4-7-16/h16H,2-15H2,1H3
C21H32N6O3416.5172201300
1232678
InChI=1/C21H32N6O3/c1-25-18-17(19(29)26(2)21(25)30)27(13-16(28)22-14-9-5-3-6-10-14)20(24-18)23-15-11-7-4-8-12-15/h14-15H,3-13H2,1-2H3,(H,22,28)(H,23,24)
C21H32N6O3416.5172201400
567330
InChI=1/C21H32N6O3/c1-21(2,3)27-19(23-24-25-27)14-26-10-8-16(9-11-26)22-20(28)13-15-6-7-17(29-4)18(12-15)30-5/h6-7,12,16H,8-11,13-14H2,1-5H3,(H,22,28)
C21H32N6O3416.517217900
11169881
InChI=1/C21H32N6O3/c1-14(2)13-26-19(28)17-18(23(5)21(26)29)22-20-25(15(3)16(4)27(17)20)8-6-7-24-9-11-30-12-10-24/h14H,6-13H2,1-5H3
C21H32N6O3416.5172171000
2460299

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H32N6O3/c1-6-21(2,3)27-20(23-24-25-27)18(26-11-9-14(10-12-26)19(22)28)16-13-15(29-4)7-8-17(16)30-5/h7-8,13-14,18H,6,9-12H2,1-5H3,(H2,22,28)
C21H32N6O3416.5172161000
566506

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H32N6O3/c1-14(2)19(26-10-8-16(9-11-26)20(22)28)21-23-24-25-27(21)12-7-15-5-6-17(29-3)18(13-15)30-4/h5-6,13-14,16,19H,7-12H2,1-4H3,(H2,22,28)
C21H32N6O3416.5172161000
11172272
InChI=1/C21H32N6O3/c1-4-5-6-7-8-25-16(2)15-27-17-18(22-20(25)27)23(3)21(29)26(19(17)28)10-9-24-11-13-30-14-12-24/h15H,4-14H2,1-3H3
C21H32N6O3416.5172151000
21033582
InChI=1/C21H32N6O3/c1-5-6-9-26-19(28)17-18(23(4)21(26)29)22-20-25(15(2)16(3)27(17)20)10-7-8-24-11-13-30-14-12-24/h5-14H2,1-4H3
C21H32N6O3416.517213800
563187

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H32N6O3/c1-25-9-11-26(12-10-25)19(21-22-23-24-27(21)16-7-5-6-8-16)15-13-17(28-2)20(30-4)18(14-15)29-3/h13-14,16,19H,5-12H2,1-4H3
C21H32N6O3416.517212800
2460291

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H32N6O3/c1-6-21(2,3)27-20(23-24-25-27)17(26-12-10-14(11-13-26)19(22)28)15-8-7-9-16(29-4)18(15)30-5/h7-9,14,17H,6,10-13H2,1-5H3,(H2,22,28)
C21H32N6O3416.517212700
559743

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H32N6O3/c1-6-16(20(29)22-15-9-7-8-10-15)27(21(3,4)5)18(28)13-26-24-19(23-25-26)17-12-11-14(2)30-17/h11-12,15-16H,6-10,13H2,1-5H3,(H,22,29)
C21H32N6O3416.517211700
22189688
InChI=1/C21H32N6O3/c1-16-8-11-26(12-9-16)15-20-23-24-25-27(20)10-4-5-21(28)22-14-17-6-7-18(29-2)13-19(17)30-3/h6-7,13,16H,4-5,8-12,14-15H2,1-3H3,(H,22,28)
C21H32N6O3416.517210800
22208227
InChI=1/C21H32N6O3/c1-14(2)6-10-27-17-7-9-26(21(29)18-12-15(3)23-25(18)4)13-16(17)19(24-27)20(28)22-8-11-30-5/h12,14H,6-11,13H2,1-5H3,(H,22,28)
C21H32N6O3416.517210900
20267932
InChI=1/C21H32N6O3/c1-14-16(6-7-17(28)22-8-9-27-12-10-24(3)11-13-27)15(2)23-19-18(14)20(29)26(5)21(30)25(19)4/h6-13H2,1-5H3,(H,22,28)
C21H32N6O3416.51729700
12345

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