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 4 results

Search term: IQHMIXCHRCLUID (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5289319

Charge

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O5/c11-9-6(4(17)1-14-12)13-3-15(9)10-8(19)7(18)5(2-16)20-10/h1,3,5,7-8,10,16,18-19H,2,11H2/p+1/b4-1-/t5-,7-,8-,10-/m1/s1
C10H14N5O5284.248662200
20129584

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H13N5O5/c11-9-6(4(17)1-14-12)13-3-15(9)10-8(19)7(18)5(2-16)20-10/h1,3,5,7-8,10,16,18-19H,2,11H2/t5-,7-,8-,10?/m1/s1
C10H13N5O5283.24071100
4589224

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O5/c11-9-6(4(17)1-14-12)13-3-15(9)10-8(19)7(18)5(2-16)20-10/h1,3,5,7-8,10,16,18-19H,2,11H2/b4-1-/t5-,7-,8-,10-/m1/s1
C10H13N5O5283.24071100

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