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: MHSHLGONJVWDLU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4653908

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H12O5/c10-8(11)3-4-9(12)14-6-7-2-1-5-13-7/h3-4,7H,1-2,5-6H2,(H,10,11)/b4-3+
C9H12O5200.1886131100
2105395

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H12O5/c10-8(11)3-4-9(12)14-6-7-2-1-5-13-7/h3-4,7H,1-2,5-6H2,(H,10,11)
C9H12O5200.188584200
5633950

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H12O5/c10-8(11)3-4-9(12)14-6-7-2-1-5-13-7/h3-4,7H,1-2,5-6H2,(H,10,11)/b4-3+/t7-/m0/s1
C9H12O5200.18862100
5633948

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H12O5/c10-8(11)3-4-9(12)14-6-7-2-1-5-13-7/h3-4,7H,1-2,5-6H2,(H,10,11)/b4-3+/t7-/m1/s1
C9H12O5200.18862100
5633949

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H12O5/c10-8(11)3-4-9(12)14-6-7-2-1-5-13-7/h3-4,7H,1-2,5-6H2,(H,10,11)/p-1/b4-3+/t7-/m0/s1
C9H11O5199.18121100
5633947

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H12O5/c10-8(11)3-4-9(12)14-6-7-2-1-5-13-7/h3-4,7H,1-2,5-6H2,(H,10,11)/p-1/b4-3+/t7-/m1/s1
C9H11O5199.18121100

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