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: BCMJULRZXHZHRC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
29400771

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m1/s1
C24H31N3O5441.524400
58156932

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m1/s1
C24H31N3O5441.522200
58156949

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m0/s1
C24H31N3O5441.522200
58156965

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m0/s1
C24H31N3O5441.522200
58156976

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m0/s1
C24H31N3O5441.522200
58156979

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m1/s1
C24H31N3O5441.522200
58156980

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m0/s1
C24H31N3O5441.522200
58157017

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m1/s1
C24H31N3O5441.522200
58157020

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m1/s1
C24H31N3O5441.522200
58157026

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m1/s1
C24H31N3O5441.522200
58157079

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m1/s1
C24H31N3O5441.522200
58157093

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m0/s1
C24H31N3O5441.522200
58157095

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m1/s1
C24H31N3O5441.522200
58157169

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m0/s1
C24H31N3O5441.522200
58157172

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m0/s1
C24H31N3O5441.522200
58157200

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m0/s1
C24H31N3O5441.522200

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