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: WJQSOAVUYCKQHE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2209597

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H19N3O3/c1-2-15-10(16)7-9(12(15)18)14-5-3-8(4-6-14)11(13)17/h8-9H,2-7H2,1H3,(H2,13,17)
C12H19N3O3253.29756211500
707630

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H19N3O3/c1-2-15-10(16)7-9(12(15)18)14-5-3-8(4-6-14)11(13)17/h8-9H,2-7H2,1H3,(H2,13,17)/t9-/m1/s1
C12H19N3O3253.29762100
707631

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H19N3O3/c1-2-15-10(16)7-9(12(15)18)14-5-3-8(4-6-14)11(13)17/h8-9H,2-7H2,1H3,(H2,13,17)/t9-/m0/s1
C12H19N3O3253.29762100
5319099

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H19N3O3/c1-2-15-10(16)7-9(12(15)18)14-5-3-8(4-6-14)11(13)17/h8-9H,2-7H2,1H3,(H2,13,17)/p+1/t9-/m1/s1
C12H20N3O3254.30551100
5319100

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H19N3O3/c1-2-15-10(16)7-9(12(15)18)14-5-3-8(4-6-14)11(13)17/h8-9H,2-7H2,1H3,(H2,13,17)/p+1/t9-/m0/s1
C12H20N3O3254.30551100

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