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 9 results

Search term: QEJOIGZDWKFVCO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2339666

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7+,8-/m0/s1
C9H12N2O4212.202586600
8528573

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7+,8+/m0/s1
C9H12N2O4212.20264200
57491784

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7+,8?/m0/s1
C9H12N2O4212.20261100
58780584

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7-,8-/m1/s1
C9H12N2O4212.20261100
58781594

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7-,8+/m1/s1
C9H12N2O4212.20261100
107445520

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7+,8+/m0/s1/i9+1,10+1,11+1
C813CH1215N2O4215.18211100
111311585

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7+,8-/m1/s1
C9H12N2O4212.20261100
111311667

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7+,8+/m1/s1/i9+1,10+1,11+1
C813CH1215N2O4215.18211100
114394353

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H12N2O4/c12-5-7-6(13)4-8(15-7)11-3-1-2-10-9(11)14/h1-3,6-8,12-13H,4-5H2/t6-,7-,8-/m1/s1/i5T/t5?,6-,7-,8-
C9H11TN2O4214.21071100

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