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: LXGBDGCDSQBZQA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2350883

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H19BrN2O2/c14-12-3-1-2-4-13(12)18-10-11(17)9-16-7-5-15-6-8-16/h1-4,11,15,17H,5-10H2
C13H19BrN2O2315.2061612800
730136

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19BrN2O2/c14-12-3-1-2-4-13(12)18-10-11(17)9-16-7-5-15-6-8-16/h1-4,11,15,17H,5-10H2/t11-/m1/s1
C13H19BrN2O2315.20622100
730138

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19BrN2O2/c14-12-3-1-2-4-13(12)18-10-11(17)9-16-7-5-15-6-8-16/h1-4,11,15,17H,5-10H2/t11-/m0/s1
C13H19BrN2O2315.20622100
2903727

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H19BrN2O2/c14-12-3-1-2-4-13(12)18-10-11(17)9-16-7-5-15-6-8-16/h1-4,11,15,17H,5-10H2/p+2
C13H21BrN2O2317.222041100
5772925

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19BrN2O2/c14-12-3-1-2-4-13(12)18-10-11(17)9-16-7-5-15-6-8-16/h1-4,11,15,17H,5-10H2/p+2/t11-/m1/s1
C13H21BrN2O2317.22091100
5772926

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H19BrN2O2/c14-12-3-1-2-4-13(12)18-10-11(17)9-16-7-5-15-6-8-16/h1-4,11,15,17H,5-10H2/p+2/t11-/m0/s1
C13H21BrN2O2317.22091100

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