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 13 results

Search term: IIZCCQJEPBWGJU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
27445349

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)
C16H19N3O5S365.40428500
27524386

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9?,10?,11-,14?/m0/s1
C16H19N3O5S365.40424400
34990950

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10-,11-,14+/m0/s1
C16H19N3O5S365.40422500
34990956

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10-,11+,14-/m1/s1
C16H19N3O5S365.40422200
26331997

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9?,10?,11-,14+/m0/s1
C16H19N3O5S365.40422300
34990957

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10-,11-,14-/m0/s1
C16H19N3O5S365.40421100
110417852

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10-,11-,14+/m1/s1
C16H19N3O5S365.40421400
34990951

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10-,11+,14+/m1/s1
C16H19N3O5S365.40421100
34990952

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10+,11+,14-/m1/s1
C16H19N3O5S365.40421100
34990953

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10+,11-,14-/m0/s1
C16H19N3O5S365.40421100
34990954

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10+,11-,14+/m0/s1
C16H19N3O5S365.40421100
34990955

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H19N3O5S/c1-16(2)11(15(23)24)19-14(25-16)10-13(22)17-9(12(21)18-10)7-3-5-8(20)6-4-7/h3-6,9-11,14,19-20H,1-2H3,(H,17,22)(H,18,21)(H,23,24)/t9-,10+,11+,14+/m1/s1
C16H19N3O5S365.40421100

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