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
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Found 6 results

Search term: APCBTRDHCDOPNY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5024368

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m1/s1
C9H17NO3187.23621459002
746438

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m0/s1
C9H17NO3187.23621396900
3617464

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3
C9H17NO3187.2361813310100
107446782

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m1/s1/i5D2,6D2
C9H13D4NO3191.26081400
111313237

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m0/s1/i5D2,6D2
C9H13D4NO3191.26081100
111331514

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/i4D2,5D2,6D2,7D
C9H10D7NO3194.27931100

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