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 8 results

Search term: KIWQWJKWBHZMDT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
96881

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2
C4H7NOS117.1695618837913
118559

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/t3-/m0/s1
C4H7NOS117.1695495700
5414332

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/t3-/m1/s1
C4H7NOS117.169513900
23375609

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/p+1
C4H8NOS118.17692100
107437576

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/i1D2,2D2
C4H3D4NOS121.19412200
396854

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/i4-1
C311CH7NOS116.17022200
5414330

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/p+1/t3-/m0/s1
C4H8NOS118.17691100
5414331

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/p+1/t3-/m1/s1
C4H8NOS118.17691100

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