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 14 results

Search term: MUSPKJVFRAYWAR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9394203

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1
C9H12N2O5S260.267363400
430980

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7+,8-/m0/s1
C9H12N2O5S260.2676500
430981

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7+,8+/m0/s1
C9H12N2O5S260.2674400
428460

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6+,7+,8+/m0/s1
C9H12N2O5S260.2674300
428484

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6+,7+,8-/m0/s1
C9H12N2O5S260.2674300
230698

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)
C9H12N2O5S260.2673200
9995987

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7+,8-/m1/s1
C9H12N2O5S260.2673200
8118741

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6+,7-,8?/m1/s1
C9H12N2O5S260.2672100
8168331

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7+,8?/m0/s1
C9H12N2O5S260.2672100
62300583

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6+,7-,8+/m0/s1
C9H12N2O5S260.2672200
23109500

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4?,6?,7?,8-/m0/s1
C9H12N2O5S260.2671100
23109587

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4?,6?,7?,8-/m1/s1
C9H12N2O5S260.2671100
57491769

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8+/m0/s1
C9H12N2O5S260.2671100
60960084

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H12N2O5S/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m0/s1
C9H12N2O5S260.2671100

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