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: JKVDTLWEIJKWGT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2050453

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H15NO4S/c14-12(15)10-5-4-8-13(9-10)18(16,17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,14,15)
C12H15NO4S269.3168665000
710318

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15NO4S/c14-12(15)10-5-4-8-13(9-10)18(16,17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,14,15)/t10-/m1/s1
C12H15NO4S269.31686500
710319

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15NO4S/c14-12(15)10-5-4-8-13(9-10)18(16,17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,14,15)/t10-/m0/s1
C12H15NO4S269.31686400
1554286

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15NO4S/c14-12(15)10-5-4-8-13(9-10)18(16,17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,14,15)/p-1/t10-/m0/s1
C12H14NO4S268.30941100
4328514

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H15NO4S/c14-12(15)10-5-4-8-13(9-10)18(16,17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,14,15)/p-1
C12H14NO4S268.308861100
5319286

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15NO4S/c14-12(15)10-5-4-8-13(9-10)18(16,17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,14,15)/p-1/t10-/m1/s1
C12H14NO4S268.308861100

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