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 10 results

Search term: ABBSOQIXYPZCKO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4589415

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/t9-,10-,12-/m0/s1
C14H19NO3S281.370611900
8101367

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/t9?,10-,12?/m0/s1
C14H19NO3S281.37065400
8554443

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/t9-,10-,12+/m0/s1
C14H19NO3S281.37065400
8214941

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/t9-,10+,12+/m1/s1
C14H19NO3S281.37062100
8531826

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/t9-,10+,12-/m1/s1
C14H19NO3S281.37062100
21200402

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/p-1/t9-,10-,12-/m0/s1
C14H18NO3S280.36321100
21200442

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/p-1/t9-,10+,12-/m1/s1
C14H18NO3S280.36321100
21200445

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/p-1/t9-,10+,12+/m1/s1
C14H18NO3S280.36321100
21200447

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/p-1/t9-,10-,12+/m0/s1
C14H18NO3S280.36321100
68024374

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C14H19NO3S/c1-9(11-6-4-3-5-7-11)12(8-19)13(16)15-10(2)14(17)18/h3-7,9-10,12,19H,8H2,1-2H3,(H,15,16)(H,17,18)/t9-,10?,12?/m0/s1
C14H19NO3S281.37061100

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