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 6 results

Search term: KRTMWLRPHKYUJX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4528148

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)22(20,24)17-11-15(13)21(20,18(25)27-3)19(26)28-17/h4-8,15,17,19,26H,9-12H2,1-3H3/b13-4-
C22H26N2O4382.45287800
4832897

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)22(20,24)17-11-15(13)21(20,18(25)27-3)19(26)28-17/h4-8,15,17,19,26H,9-12H2,1-3H3/b13-4+
C22H26N2O4382.45283500
145047

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)22(20,24)17-11-15(13)21(20,18(25)27-3)19(26)28-17/h4-8,15,17,19,26H,9-12H2,1-3H3
C22H26N2O4382.45282100
74168739

Double-bond stereo

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)22(20,24)17-11-15(13)21(20,18(25)27-3)19(26)28-17/h4-8,15,17,19,26H,9-12H2,1-3H3/b13-4-/t15-,17+,19?,20-,21-,22?/m0/s1
C22H26N2O4382.45281100
75583369

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)22(20,24)17-11-15(13)21(20,18(25)27-3)19(26)28-17/h4-8,15,17,19,26H,9-12H2,1-3H3/b13-4-/t15-,17+,19+,20-,21?,22-/m0/s1
C22H26N2O4382.45281100
4572799

Double-bond stereo

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)22(20,24)17-11-15(13)21(20,18(25)27-3)19(26)28-17/h4-8,15,17,19,26H,9-12H2,1-3H3/b13-4-/t15?,17-,19-,20?,21?,22+/m1/s1
C22H26N2O4382.45281100

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