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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 1600 results

Search term: C21H33N3O5 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
79864

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H33N3O5/c1-12(2)9-16(22)19(26)23-17(10-13(3)4)20(27)24-18(21(28)29)11-14-5-7-15(25)8-6-14/h5-8,12-13,16-18,25H,9-11,22H2,1-4H3,(H,23,26)(H,24,27)(H,28,29)/t16-,17-,18-/m0/s1
C21H33N3O5407.5038337700
2185375
InChI=1/C19H31N3O.C2H2O4/c1-17-3-2-4-18(15-17)16-21-7-5-19(6-8-21)22-11-9-20(10-12-22)13-14-23;3-1(4)2(5)6/h2-4,15,19,23H,5-14,16H2,1H3;(H,3,4)(H,5,6)
C21H33N3O5407.50382131300
2186152
InChI=1/C19H31N3O.C2H2O4/c1-16(2)20-10-8-17(9-11-20)21-12-14-22(15-13-21)18-6-4-5-7-19(18)23-3;3-1(4)2(5)6/h4-7,16-17H,8-15H2,1-3H3;(H,3,4)(H,5,6)
C21H33N3O5407.50382131200
2994284
InChI=1/C21H33N3O5/c1-26-19-4-5-20(27-2)18(16-19)17-24(21(25)23-10-14-29-15-11-23)7-3-6-22-8-12-28-13-9-22/h4-5,16H,3,6-15,17H2,1-2H3
C21H33N3O5407.50382131000
3010017
InChI=1/C21H33N3O5/c1-26-19-6-3-5-18(20(19)27-2)17-24(21(25)23-11-15-29-16-12-23)8-4-7-22-9-13-28-14-10-22/h3,5-6H,4,7-17H2,1-2H3
C21H33N3O5407.5038213900
3619520
InChI=1/C21H33N3O5/c1-26-19-5-4-18(16-20(19)27-2)17-24(21(25)23-10-14-29-15-11-23)7-3-6-22-8-12-28-13-9-22/h4-5,16H,3,6-15,17H2,1-2H3
C21H33N3O5407.50382131000
4211032
InChI=1/C21H33N3O5/c1-21(2)19(27)23(20(28)22-21)13-18(26)29-14-17(25)24(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h15-16H,3-14H2,1-2H3,(H,22,28)
C21H33N3O5407.5038212800
2362749

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H33N3O5/c1-14(2)11-16(18(22)25)23-19(26)17(24-20(27)29-21(3,4)5)13-28-12-15-9-7-6-8-10-15/h6-10,14,16-17H,11-13H2,1-5H3,(H2,22,25)(H,23,26)(H,24,27)
C21H33N3O5407.5038212800
2492841
InChI=1/C21H33N3O5/c1-27-17-14-16(15-18(28-2)20(17)29-3)21(26)23-10-8-19(25)22-9-7-13-24-11-5-4-6-12-24/h14-15H,4-13H2,1-3H3,(H,22,25)(H,23,26)
C21H33N3O5407.5038121000
206516
InChI=1/C21H33N3O5/c25-20-17(14-22-1-7-27-8-2-22)13-18(15-23-3-9-28-10-4-23)21(26)19(20)16-24-5-11-29-12-6-24/h13,25-26H,1-12,14-16H2
C21H33N3O5407.503812800
21347920
InChI=1/C19H31N3O.C2H2O4/c1-17-4-2-3-5-18(17)16-21-8-6-19(7-9-21)22-12-10-20(11-13-22)14-15-23;3-1(4)2(5)6/h2-5,19,23H,6-16H2,1H3;(H,3,4)(H,5,6)
C21H33N3O5407.5038121100
5730891

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H33N3O5/c1-12(2)9-16(22)19(26)23-17(11-14-5-7-15(25)8-6-14)20(27)24-18(21(28)29)10-13(3)4/h5-8,12-13,16-18,25H,9-11,22H2,1-4H3,(H,23,26)(H,24,27)(H,28,29)/t16-,17-,18-/m0/s1
C21H33N3O5407.503811700
21343007
InChI=1/C19H31N3O.C2H2O4/c1-3-23-19-6-4-17(5-7-19)16-21-10-8-18(9-11-21)22-14-12-20(2)13-15-22;3-1(4)2(5)6/h4-7,18H,3,8-16H2,1-2H3;(H,3,4)(H,5,6)
C21H33N3O5407.503811900
2493696
InChI=1/C21H33N3O5/c1-27-17-14-16(15-18(28-2)20(17)29-3)21(26)23-9-8-19(25)22-10-13-24-11-6-4-5-7-12-24/h14-15H,4-13H2,1-3H3,(H,22,25)(H,23,26)
C21H33N3O5407.503810800
22227696

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H33N3O5/c1-2-28-21(26)24-8-6-22(7-9-24)15-18-4-3-5-20(14-18)29-17-19(25)16-23-10-12-27-13-11-23/h3-5,14,19,25H,2,6-13,15-17H2,1H3
C21H33N3O5407.503810800
22233970

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H33N3O5/c1-17(25)24-8-6-22(7-9-24)14-18-4-3-5-20(27-2)21(18)29-16-19(26)15-23-10-12-28-13-11-23/h3-5,19,26H,6-16H2,1-2H3
C21H33N3O5407.503810800
31101274
InChI=1/C21H33N3O5/c1-20(2,3)29-19(28)22-15-6-11-23(12-7-15)16(25)8-13-24-17(26)14-21(18(24)27)9-4-5-10-21/h15H,4-14H2,1-3H3,(H,22,28)
C21H33N3O5407.503810800
22147473

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H33N3O5/c1-15(2)29-9-5-6-22-20(25)13-19-21(26)23-7-8-24(19)14-16-10-17(27-3)12-18(11-16)28-4/h10-12,15,19H,5-9,13-14H2,1-4H3,(H,22,25)(H,23,26)
C21H33N3O5407.50389800
22168982

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H33N3O5/c1-15(2)24(8-9-27-3)20(25)13-19-21(26)22-6-7-23(19)14-16-10-17(28-4)12-18(11-16)29-5/h10-12,15,19H,6-9,13-14H2,1-5H3,(H,22,26)
C21H33N3O5407.50389800
22191251

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H33N3O5/c1-5-29-20(25)14-22-21(26)24-11-6-7-17(15-24)23(2)12-10-16-8-9-18(27-3)19(13-16)28-4/h8-9,13,17H,5-7,10-12,14-15H2,1-4H3,(H,22,26)
C21H33N3O5407.50389700
12345

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