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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 27 results

Search term: UUGITDASWNOAGG (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
705423

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7+,8-/m1/s1
C9H10N2O5226.1861997514
89386

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2
C9H10N2O5226.186124280199
29271939

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6+,7-,8-/m0/s1
C9H10N2O5226.1861161300
9043262

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7+,8-/m0/s1
C9H10N2O5226.186113800
4484200

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7-,8-/m1/s1
C9H10N2O5226.1861101000
64862523

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7-,8-/m0/s1
C9H10N2O5226.18618800
21509831

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4?,6-,7?,8?/m1/s1
C9H10N2O5226.18615300
5050926

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6+,7?,8-/m1/s1
C9H10N2O5226.18615500
10067255

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6+,7+,8-/m1/s1
C9H10N2O5226.18614300
29787236

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6?,7?,8-/m0/s1
C9H10N2O5226.18614400
29787237

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6?,7?,8-/m1/s1
C9H10N2O5226.18614400
5318842

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6+,7+,8+/m1/s1
C9H10N2O5226.18613200
10067256

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6+,7-,8-/m1/s1
C9H10N2O5226.18612100
9217624

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7+,8-/m1/s1/i14+1
C9H10N2O417O227.18582200
9271490

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7+,8-/m1/s1/i14+2
C9H10N2O418O228.18592200
10034849

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6+,7-,8+/m1/s1
C9H10N2O5226.18612100
614144

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7-,8+/m0/s1
C9H10N2O5226.18612100
2063915

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6?,7+,8+/m1/s1
C9H10N2O5226.18612200
4440605

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7?,8-/m0/s1
C9H10N2O5226.18612200
12

Advertisement