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: HLKXYZVTANABHZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
273

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)
C5H8N2O5176.127410315236
84022

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/t2-/m0/s1
C5H8N2O5176.12745113620
1267120

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/t2-/m1/s1
C5H8N2O5176.1274131200
4573859

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/p-2/t2-/m0/s1
C5H6N2O5174.112686334
10718031

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/p-2
C5H6N2O5174.1126310665
21239270

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/p-1/t2-/m1/s1
C5H7N2O5175.122100
57267175

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/i5+2
C414CH8N2O5178.122100
57268069

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/t2-/m0/s1/i5+2
C414CH8N2O5178.122100
1267119

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/p-2/t2-/m1/s1
C5H6N2O5174.11262100

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