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 16 results

Search term: OQAVOTYRCZUZIX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4654294

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+
C12H17N3O6299.279910600
4758036

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5-
C12H17N3O6299.27998600
5751574

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+/t8-,9+,10+,11+/m0/s1
C12H17N3O6299.27995300
2106990

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)
C12H17N3O6299.279884200
5751577

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+/t8-,9-,10-,11-/m1/s1
C12H17N3O6299.27993100
5973169

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5-/t8-,9+,10-,11+/m0/s1
C12H17N3O6299.27992100
5973170

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5-/t8-,9-,10+,11-/m1/s1
C12H17N3O6299.27992100
5973171

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5-/t8-,9-,10-,11-/m1/s1
C12H17N3O6299.27992100
7848689

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5-/t8-,9+,10+,11-/m0/s1
C12H17N3O6299.27992200
9954161

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+/t8-,9+,10+,11+/m1/s1
C12H17N3O6299.27992100
4976114

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5-/t8-,9+,10+,11+/m0/s1
C12H17N3O6299.27992100
5751569

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+/t8-,9+,10-,11+/m0/s1
C12H17N3O6299.27992100
5751572

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+/t8-,9-,10+,11-/m1/s1
C12H17N3O6299.27992100
90664886

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/b14-5+/t8-,9-,10-,11+/m0/s1
C12H17N3O6299.27991100
103883163

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C12H17N3O6/c16-6-9(18)11(20)10(19)8(17)5-14-15-12(21)7-1-3-13-4-2-7/h1-5,8-11,16-20H,6H2,(H,15,21)/t8-,9+,10+,11+/m0/s1
C12H17N3O6299.27991100

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