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: VRHVHBIUCNRUOK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2392856

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H16N2O6S/c1-8(2)7-9(12(15)16)13-21(19,20)11-6-4-3-5-10(11)14(17)18/h3-6,8-9,13H,7H2,1-2H3,(H,15,16)
C12H16N2O6S316.33024191200
612429

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O6S/c1-8(2)7-9(12(15)16)13-21(19,20)11-6-4-3-5-10(11)14(17)18/h3-6,8-9,13H,7H2,1-2H3,(H,15,16)/t9-/m0/s1
C12H16N2O6S316.33028800
612430

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O6S/c1-8(2)7-9(12(15)16)13-21(19,20)11-6-4-3-5-10(11)14(17)18/h3-6,8-9,13H,7H2,1-2H3,(H,15,16)/t9-/m1/s1
C12H16N2O6S316.33026600
2847294

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H16N2O6S/c1-8(2)7-9(12(15)16)13-21(19,20)11-6-4-3-5-10(11)14(17)18/h3-6,8-9,13H,7H2,1-2H3,(H,15,16)/p-1
C12H15N2O6S315.32231100
5298357

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O6S/c1-8(2)7-9(12(15)16)13-21(19,20)11-6-4-3-5-10(11)14(17)18/h3-6,8-9,13H,7H2,1-2H3,(H,15,16)/p-1/t9-/m0/s1
C12H15N2O6S315.32231100
5298358

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O6S/c1-8(2)7-9(12(15)16)13-21(19,20)11-6-4-3-5-10(11)14(17)18/h3-6,8-9,13H,7H2,1-2H3,(H,15,16)/p-1/t9-/m1/s1
C12H15N2O6S315.32231100

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