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: XEQIXGXEBJYNMG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4578301

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21-,27-24-
C27H33ClN2O2453.016127400
9234612

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21-,27-24-/t18-,23-/m1/s1
C27H33ClN2O2453.01612100
9298401

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21-,27-24-/t18-,23-/m0/s1
C27H33ClN2O2453.01612100
9330333

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21-,27-24+/t18-,23-/m1/s1
C27H33ClN2O2453.01612100
59700946

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21-,27-24-/t18?,23-/m1/s1
C27H33ClN2O2453.01612100
59701859

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21-,27-24-/t18-,23+/m0/s1
C27H33ClN2O2453.01612100
331590

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3
C27H33ClN2O2453.01612100
95570450

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21+,27-24-
C27H33ClN2O2453.01611100
57539162

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21+,27-24-/t18-,23-/m1/s1
C27H33ClN2O2453.01611100
58816029

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,30H,4-11H2,1-3H3/b26-21+,27-24u
C27H33ClN2O2453.01611100

Advertisement