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 5 results

Search term: NTDGNQPSGKSDNT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2360708

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H14N4O3/c1-12(2)11-8(14)5-7(9(15)16)13-4-3-10-6-13/h3-4,6-7H,5H2,1-2H3,(H,11,14)(H,15,16)
C9H14N4O3226.232468400
5657655

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N4O3/c1-12(2)11-8(14)5-7(9(15)16)13-4-3-10-6-13/h3-4,6-7H,5H2,1-2H3,(H,11,14)(H,15,16)/t7-/m0/s1
C9H14N4O3226.23252100
5657657

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N4O3/c1-12(2)11-8(14)5-7(9(15)16)13-4-3-10-6-13/h3-4,6-7H,5H2,1-2H3,(H,11,14)(H,15,16)/t7-/m1/s1
C9H14N4O3226.23252100
5657656

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N4O3/c1-12(2)11-8(14)5-7(9(15)16)13-4-3-10-6-13/h3-4,6-7H,5H2,1-2H3,(H,11,14)(H,15,16)/p-1/t7-/m1/s1
C9H13N4O3225.22511100
5657654

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N4O3/c1-12(2)11-8(14)5-7(9(15)16)13-4-3-10-6-13/h3-4,6-7H,5H2,1-2H3,(H,11,14)(H,15,16)/p-1/t7-/m0/s1
C9H13N4O3225.22511100

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