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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Isotopically Labeled
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Found 287 results

Search term: C6H6N4O3 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
62926
InChI=1/C6H6N4O3/c1-10-4(11)2-3(9-6(10)13)8-5(12)7-2/h1H3,(H,9,13)(H2,7,8,12)
C6H6N4O3182.13688421700
62375
InChI=1/C6H6N4O3/c1-10-2-3(8-6(10)13)7-5(12)9-4(2)11/h1H3,(H3,7,8,9,11,12,13)
C6H6N4O3182.1368758500
97755
InChI=1/C6H6N4O3/c1-10-3-2(7-6(10)13)4(11)9-5(12)8-3/h1H3,(H,7,13)(H2,8,9,11,12)
C6H6N4O3182.1368546000
11311
InChI=1/C6H6N4O3/c1-10-3-2(7-5(12)8-3)4(11)9-6(10)13/h1H3,(H2,7,8,12)(H,9,11,13)
C6H6N4O3182.1368486100
21613525
InChI=1/C6H6N4O3/c7-5(12)3-4(6(8)13)10-2(11)1-9-3/h1H,(H2,7,12)(H2,8,13)(H,10,11)
C6H6N4O3182.1368301700
29339817
InChI=1/C6H6N4O3/c7-5-3(6(8)11)1-9-2-4(5)10(12)13/h1-2H,(H2,7,9)(H2,8,11)
C6H6N4O3182.1368261700
4461023
InChI=1/C6H6N4O3/c7-5-4(6(8)11)1-3(2-9-5)10(12)13/h1-2H,(H2,7,9)(H2,8,11)
C6H6N4O3182.13684251700
29201916
InChI=1/C6H6N4O3/c11-5-4-3(6(12)13)8-9-10(4)2-1-7-5/h1-2H2,(H,7,11)(H,12,13)
C6H6N4O3182.1368181500
4587146
InChI=1/C6H6N4O3/c7-9-6(11)4-1-2-8-5(3-4)10(12)13/h1-3H,7H2,(H,9,11)
C6H6N4O3182.1368171400
225966
InChI=1/C6H6N4O3/c1-9-2-7-4-3(9)5(11)10(13)6(12)8-4/h2,13H,1H3,(H,8,12)
C6H6N4O3182.1368171300
4795031

Double-bond stereo
InChI=1/C6H6N4O3/c11-5(1-2-6(12)13)9-10-3-7-8-4-10/h1-4H,(H,9,11)(H,12,13)/b2-1+
C6H6N4O3182.1368161000
1540955
InChI=1/C6H6N4O3/c1-11-5-6(12-2)8-4-3(7-5)9-13-10-4/h1-2H3
C6H6N4O3182.1368161000
2065323
InChI=1/C6H6N4O3/c1-9-4-3(7-13-8-4)5(11)10(2)6(9)12/h1-2H3
C6H6N4O3182.13684161100
75917
InChI=1/C6H6N4O3/c1-9-5(11)3-4(8-2-7-3)10(13)6(9)12/h2,13H,1H3,(H,7,8)
C6H6N4O3182.1368151500
233366
InChI=1/C6H6N4O3/c1-9-4-3(2-7-9)8-6(12)10(13)5(4)11/h2,13H,1H3,(H,8,12)
C6H6N4O3182.1368141000
17729245

Double-bond stereo
InChI=1/C6H6N4O3/c11-7-3-1-2-4-6(5(3)8-12)10-13-9-4/h11-12H,1-2H2/b7-3-,8-5+
C6H6N4O3182.136814900
518249

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H6N4O3/c11-4-5(12)9-3-2(8-4)1-7-6(13)10-3/h1,5,12H,(H,8,11)(H2,7,9,10,13)
C6H6N4O3182.1368141400
233363
InChI=1/C6H6N4O3/c1-9-2-3-4(8-9)7-6(12)10(13)5(3)11/h2,13H,1H3,(H,7,8,12)
C6H6N4O3182.136813800
312321
InChI=1/C6H6N4O3/c7-5-4(10(12)13)1-3(2-9-5)6(8)11/h1-2H,(H2,7,9)(H2,8,11)
C6H6N4O3182.136812700
61182061
InChI=1/C6H6N4O3/c11-6-4-3-5(10(12)13)8-9(4)2-1-7-6/h3H,1-2H2,(H,7,11)
C6H6N4O3182.1368121300
12345

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