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 11 results

Search term: HAGBWVNSVWLTKY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
34985952

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4-/t16-,18-,20-,21-,22+/m0/s1
C22H26N2O3366.45347700
4585686

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4+
C22H26N2O3366.45345500
34967027

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4-/t16-,18+,20?,21+,22-/m1/s1
C22H26N2O3366.45345300
4952819

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4-/t16-,18-,20?,21-,22?/m0/s1
C22H26N2O3366.45344400
385622

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3
C22H26N2O3366.45342100
52083834

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4-/t16?,18?,20-,21-,22+/m0/s1
C22H26N2O3366.45341100
74168738

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4-/t16-,18?,20-,21-,22+/m0/s1
C22H26N2O3366.45341100
114553155

Double-bond stereo

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4-/t16?,18?,20?,21-,22+/m1/s1
C22H26N2O3366.45341100
129310563

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/t16-,18-,20?,21-,22?/m0/s1
C22H26N2O3366.45341100

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