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 6 results

Search term: HBNIPLONHFFQIY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2745824

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C12H16N4O2/c17-10(18)11-2-8-1-9(3-11)5-12(4-8,6-11)16-14-7-13-15-16/h7-9H,1-6H2,(H,17,18)
C12H16N4O2248.28104403000
26495921

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H16N4O2/c17-10(18)11-2-8-1-9(3-11)5-12(4-8,6-11)16-14-7-13-15-16/h7-9H,1-6H2,(H,17,18)/t8-,9+,11+,12-
C12H16N4O2248.2817300
736257

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C12H16N4O2/c17-10(18)11-2-8-1-9(3-11)5-12(4-8,6-11)16-14-7-13-15-16/h7-9H,1-6H2,(H,17,18)/t8-,9+,11?,12?
C12H16N4O2248.2812100
67865159

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C12H16N4O2/c17-10(18)11-2-8-1-9(3-11)5-12(4-8,6-11)16-14-7-13-15-16/h7-9H,1-6H2,(H,17,18)/t8?,9?,11-,12+
C12H16N4O2248.2811100
3931995

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C12H16N4O2/c17-10(18)11-2-8-1-9(3-11)5-12(4-8,6-11)16-14-7-13-15-16/h7-9H,1-6H2,(H,17,18)/p-1
C12H15N4O2247.27361100
5322274

Charge

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C12H16N4O2/c17-10(18)11-2-8-1-9(3-11)5-12(4-8,6-11)16-14-7-13-15-16/h7-9H,1-6H2,(H,17,18)/p-1/t8-,9+,11?,12?
C12H15N4O2247.27311100

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