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 7 results

Search term: VCKPUUFAIGNJHC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
87

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)
C10H12N2O4224.213289813300
11318

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/t6-/m0/s1
C10H12N2O4224.21335434500
5036599

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/t6-/m1/s1
C10H12N2O4224.2133311800
49073159

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/i6+1,10+1
C813C2H12N2O4226.19868700
48060682

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/i6+1,10+1,11+1
C813C2H12N15NO4227.1927700
98644569

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/i4+1,6+1,10+1,11+1
C713C3H12N15NO4228.18472200
115006476

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)/i1D,4D2
C10H9D3N2O4227.23181100

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