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: MTCPVWYULUALKM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4143902

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H9N3O2S2/c1-5(8(13)14)12-7(10-11-9(12)15)6-3-2-4-16-6/h2-5H,1H3,(H,11,15)(H,13,14)
C9H9N3O2S2255.31666312300
5472910

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H9N3O2S2/c1-5(8(13)14)12-7(10-11-9(12)15)6-3-2-4-16-6/h2-5H,1H3,(H,11,15)(H,13,14)/t5-/m0/s1
C9H9N3O2S2255.316713500
5472912

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H9N3O2S2/c1-5(8(13)14)12-7(10-11-9(12)15)6-3-2-4-16-6/h2-5H,1H3,(H,11,15)(H,13,14)/t5-/m1/s1
C9H9N3O2S2255.31672100
5472911

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H9N3O2S2/c1-5(8(13)14)12-7(10-11-9(12)15)6-3-2-4-16-6/h2-5H,1H3,(H,11,15)(H,13,14)/p-1/t5-/m1/s1
C9H8N3O2S2254.30931100
5472909

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H9N3O2S2/c1-5(8(13)14)12-7(10-11-9(12)15)6-3-2-4-16-6/h2-5H,1H3,(H,11,15)(H,13,14)/p-1/t5-/m0/s1
C9H8N3O2S2254.30931100

Advertisement