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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 12094 results

Search term: C22H28N2O4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4444758


Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22+/m0/s1
C22H28N2O4384.468752560276
2300899

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22-/m0/s1
C22H28N2O4384.4687514400
2367665
InChI=1/C22H28N2O4/c1-3-27-19-13-9-17(10-14-19)23-21(25)7-5-6-8-22(26)24-18-11-15-20(16-12-18)28-4-2/h9-16H,3-8H2,1-2H3,(H,23,25)(H,24,26)
C22H28N2O4384.46872382300
8650526

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15+,19+,22+/m1/s1
C22H28N2O4384.4687383600
28567640

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O4/c1-22(2,3)28-21(27)24-12-6-11-23(13-14-24)19(20(25)26)18-10-9-16-7-4-5-8-17(16)15-18/h4-5,7-10,15,19H,6,11-14H2,1-3H3,(H,25,26)
C22H28N2O4384.4687373000
29365362

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H28N2O4/c1-22(2,3)28-21(27)23-18-9-6-12-24(14-18)19(20(25)26)17-11-10-15-7-4-5-8-16(15)13-17/h4-5,7-8,10-11,13,18-19H,6,9,12,14H2,1-3H3,(H,23,27)(H,25,26)
C22H28N2O4384.4687322500
8266961

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15+,19+,22-/m1/s1
C22H28N2O4384.4687323000
29365374

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O4/c1-22(2,3)28-21(27)23-18-10-12-24(13-11-18)19(20(25)26)17-9-8-15-6-4-5-7-16(15)14-17/h4-9,14,18-19H,10-13H2,1-3H3,(H,23,27)(H,25,26)
C22H28N2O4384.4687312300
1060905
InChI=1/C22H28N2O4/c1-15-6-7-18(16(2)12-15)23-8-10-24(11-9-23)22(25)17-13-19(26-3)21(28-5)20(14-17)27-4/h6-7,12-14H,8-11H2,1-5H3
C22H28N2O4384.4687312000
1404367
InChI=1/C22H28N2O4/c1-15-5-7-17(3)19(11-15)27-13-21(25)23-9-10-24-22(26)14-28-20-12-16(2)6-8-18(20)4/h5-8,11-12H,9-10,13-14H2,1-4H3,(H,23,25)(H,24,26)
C22H28N2O4384.4687301800
1060418
InChI=1/C22H28N2O4/c1-15-7-6-8-18(16(15)2)23-9-11-24(12-10-23)22(25)17-13-19(26-3)21(28-5)20(14-17)27-4/h6-8,13-14H,9-12H2,1-5H3
C22H28N2O4384.4687301900
858978
InChI=1/C22H28N2O4/c1-15-6-7-18(12-16(15)2)23-8-10-24(11-9-23)22(25)17-13-19(26-3)21(28-5)20(14-17)27-4/h6-7,12-14H,8-11H2,1-5H3
C22H28N2O4384.4687292200
1284476
InChI=1/C22H28N2O4/c1-5-16-6-10-18(11-7-16)27-14-20(25)23-24-21(26)15-28-19-12-8-17(9-13-19)22(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,23,25)(H,24,26)
C22H28N2O4384.4687291500
2131410

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O4/c1-14-19(22(26)28-13-12-27-4)20(15-8-10-16(11-9-15)24(2)3)21-17(23-14)6-5-7-18(21)25/h8-11,20,23H,5-7,12-13H2,1-4H3
C22H28N2O4384.46872281900
2212915

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O4/c1-2-27-22(26)24-14-12-23(13-15-24)16-20(25)17-28-21-10-8-19(9-11-21)18-6-4-3-5-7-18/h3-11,20,25H,2,12-17H2,1H3
C22H28N2O4384.46872272000
1648398
InChI=1/C22H28N2O4/c1-15-7-16(2)10-19(9-15)27-13-21(25)23-5-6-24-22(26)14-28-20-11-17(3)8-18(4)12-20/h7-12H,5-6,13-14H2,1-4H3,(H,23,25)(H,24,26)
C22H28N2O4384.4687271900
2108678
InChI=1/C22H28N2O4/c1-27-19-13-9-17(10-14-19)23-21(25)7-5-3-4-6-8-22(26)24-18-11-15-20(28-2)16-12-18/h9-16H,3-8H2,1-2H3,(H,23,25)(H,24,26)
C22H28N2O4384.46872271500
931830
InChI=1/C22H28N2O4/c1-15-9-11-24(12-10-15)18-7-5-17(6-8-18)23-22(25)16-13-19(26-2)21(28-4)20(14-16)27-3/h5-8,13-15H,9-12H2,1-4H3,(H,23,25)
C22H28N2O4384.4687261400
214118
InChI=1/C22H28N2O4/c1-5-16-8-6-7-9-18(16)23-10-12-24(13-11-23)22(25)17-14-19(26-2)21(28-4)20(15-17)27-3/h6-9,14-15H,5,10-13H2,1-4H3
C22H28N2O4384.4687261800
944453
InChI=1/C22H28N2O4/c1-4-27-20-11-10-17(16-21(20)28-5-2)22(25)24-14-12-23(13-15-24)18-8-6-7-9-19(18)26-3/h6-11,16H,4-5,12-15H2,1-3H3
C22H28N2O4384.4687251700
12345

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