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 13 results

Search term: HBDWQSHEVMSFGY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
389696

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3+/m0/s1
C5H9NO5163.1287524501
167304

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3-/m0/s1
C5H9NO5163.1287413500
816

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)
C5H9NO5163.1287243100
388936

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3?/m0/s1
C5H9NO5163.1287172900
21230576

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3+/m1/s1
C5H9NO5163.128712600
5341963

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/p-1/t2-,3+/m0/s1
C5H8NO5162.12135400
4573749

Charge

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/p-2/t2-,3?/m0/s1
C5H7NO5161.1139331115
4574247

Charge

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/p-1/t2-,3?/m0/s1
C5H8NO5162.121331300
61327032

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3?/m1/s1
C5H9NO5163.12873200
61327007

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3-/m1/s1
C5H9NO5163.12872200
5342118

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/p-1/t2-,3-/m0/s1
C5H8NO5162.12131100
19951431

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/p-2
C5H7NO5161.11391101

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