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: IYLRRIUNGGQRTN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
498515

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3
C21H26N2O2338.4433111600
10045242

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19+,20+,21+/m0/s1
C21H26N2O2338.44339400
10254846

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18-,19+,20+,21+/m0/s1
C21H26N2O2338.4433981130
141058

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18?,19+,20+,21+/m0/s1
C21H26N2O2338.44335400
23718353

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19+,20+,21-/m0/s1
C21H26N2O2338.44333200
88297823

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19-,20-,21+/m0/s1
C21H26N2O2338.44333200
64849825

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19?,20+,21?/m0/s1
C21H26N2O2338.44332300
10045244

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18-,19-,20-,21-/m1/s1
C21H26N2O2338.44332100
19988961

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18-,19?,20+,21?/m0/s1
C21H26N2O2338.44332200
23310944

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19-,20-,21-/m1/s1
C21H26N2O2338.44332200
10045243

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/p+1/t15-,18-,19-,20-,21-/m1/s1
C21H27N2O2339.45071100
10045241

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/p+1/t15-,18+,19+,20+,21+/m0/s1
C21H27N2O2339.45071100

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