Matches any text strings used to describe a molecule.
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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Single/Multi-component
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Found 4831 results

Search term: C21H22ClN3O2 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8286062
InChI=1/C21H22ClN3O2/c1-4-18-19(22)20(25(3)24-18)21(26)23-13-15-7-11-17(12-8-15)27-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3,(H,23,26)
C21H22ClN3O2383.8713828700
1022219
InChI=1/C21H22ClN3O2/c22-16-6-7-18-17(14-16)19(15-4-2-1-3-5-15)20(21(27)23-18)25-10-8-24(9-11-25)12-13-26/h1-7,14,26H,8-13H2,(H,23,27)
C21H22ClN3O2383.8713292000
878603
InChI=1/C21H22ClN3O2/c1-2-24-10-12-25(13-11-24)20-16(22)7-5-8-17(20)23-21(26)19-14-15-6-3-4-9-18(15)27-19/h3-9,14H,2,10-13H2,1H3,(H,23,26)
C21H22ClN3O2383.8713281700
2110292

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c22-17-7-4-8-18(13-17)25-20(26)14-19(21(25)27)24-11-9-23(10-12-24)15-16-5-2-1-3-6-16/h1-8,13,19H,9-12,14-15H2
C21H22ClN3O2383.87128271800
2125815

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c1-15-4-2-7-18(12-15)25-20(26)14-19(21(25)27)24-10-8-23(9-11-24)17-6-3-5-16(22)13-17/h2-7,12-13,19H,8-11,14H2,1H3
C21H22ClN3O2383.87128271800
2126859

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c1-15-5-4-6-16(13-15)25-20(26)14-19(21(25)27)24-11-9-23(10-12-24)18-8-3-2-7-17(18)22/h2-8,13,19H,9-12,14H2,1H3
C21H22ClN3O2383.87128271800
1027962
InChI=1/C21H22ClN3O2/c1-4-25(5-2)16-12-10-15(11-13-16)23-21(26)19-14(3)27-24-20(19)17-8-6-7-9-18(17)22/h6-13H,4-5H2,1-3H3,(H,23,26)
C21H22ClN3O2383.8713251700
2194980

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c1-15-7-8-16(22)13-18(15)25-20(26)14-19(21(25)27)24-11-9-23(10-12-24)17-5-3-2-4-6-17/h2-8,13,19H,9-12,14H2,1H3
C21H22ClN3O2383.87128241600
1165668
InChI=1/C21H22ClN3O2/c1-2-24-9-11-25(12-10-24)18-8-7-16(14-17(18)22)23-21(26)20-13-15-5-3-4-6-19(15)27-20/h3-8,13-14H,2,9-12H2,1H3,(H,23,26)
C21H22ClN3O2383.8713231400
1000711
InChI=1/C21H22ClN3O2/c1-5-27-21(26)17-12-23-19-13(2)18(22)11-10-16(19)20(17)24-14-6-8-15(9-7-14)25(3)4/h6-12H,5H2,1-4H3,(H,23,24)
C21H22ClN3O2383.8713231200
1003191
InChI=1/C21H22ClN3O2/c1-5-27-21(26)18-12-23-19-13(2)10-14(22)11-17(19)20(18)24-15-6-8-16(9-7-15)25(3)4/h6-12H,5H2,1-4H3,(H,23,24)
C21H22ClN3O2383.8713221200
2404642

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c22-17-8-4-5-9-18(17)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)15-16-6-2-1-3-7-16/h1-9,19H,10-15H2
C21H22ClN3O2383.8713221300
2111158

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c1-15-3-2-4-18(13-15)25-20(26)14-19(21(25)27)24-11-9-23(10-12-24)17-7-5-16(22)6-8-17/h2-8,13,19H,9-12,14H2,1H3
C21H22ClN3O2383.87128221600
6342034

Double-bond stereo
InChI=1/C21H22ClN3O2/c1-16(26)23-18-8-9-20(19(22)15-18)24-11-13-25(14-12-24)21(27)10-7-17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3,(H,23,26)/b10-7+
C21H22ClN3O2383.8713211700
1313042
InChI=1/C21H22ClN3O2/c1-2-6-19(26)27-14-5-13-23-21-17-7-3-4-8-18(17)24-20(25-21)15-9-11-16(22)12-10-15/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,23,24,25)
C21H22ClN3O2383.8713211200
1455359
InChI=1/C21H22ClN3O2/c1-2-3-13-23-19(26)12-14-25-21(27)18-7-5-4-6-17(18)20(24-25)15-8-10-16(22)11-9-15/h4-11H,2-3,12-14H2,1H3,(H,23,26)
C21H22ClN3O2383.8713211500
1457400
InChI=1/C21H22ClN3O2/c1-21(2,3)23-18(26)12-13-25-20(27)17-7-5-4-6-16(17)19(24-25)14-8-10-15(22)11-9-14/h4-11H,12-13H2,1-3H3,(H,23,26)
C21H22ClN3O2383.8713211200
2110294

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c22-17-6-8-18(9-7-17)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)15-16-4-2-1-3-5-16/h1-9,19H,10-15H2
C21H22ClN3O2383.87128201400
2912961
InChI=1/C21H22ClN3O2/c22-17-5-9-18(10-6-17)23-12-14-24(15-13-23)21(27)16-3-7-19(8-4-16)25-11-1-2-20(25)26/h3-10H,1-2,11-15H2
C21H22ClN3O2383.87128201600
4494520

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22ClN3O2/c1-14-10-16(15(2)25(14)19-7-5-18(22)6-8-19)11-17(12-23)21(26)24-13-20-4-3-9-27-20/h5-8,10-11,20H,3-4,9,13H2,1-2H3,(H,24,26)/b17-11+
C21H22ClN3O2383.8713201400
12345

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