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 9 results

Search term: ACFQUUKSVVTRLU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3241440

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)
C22H31NO4373.4858151100
5611694

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/t19-,20-/m1/s1
C22H31NO4373.48582100
5611696

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/t19-,20+/m0/s1
C22H31NO4373.48582100
5611698

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/t19-,20+/m1/s1
C22H31NO4373.48582100
5611700

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/t19-,20-/m0/s1
C22H31NO4373.48582100
5611699

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/p-1/t19-,20-/m0/s1
C22H30NO4372.47841100
5611697

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/p-1/t19-,20+/m1/s1
C22H30NO4372.47841100
5611695

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/p-1/t19-,20+/m0/s1
C22H30NO4372.47841100
5611693

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H31NO4/c24-21(19-8-4-5-9-20(19)22(25)26)23-17-10-12-18(13-11-17)27-15-14-16-6-2-1-3-7-16/h10-13,16,19-20H,1-9,14-15H2,(H,23,24)(H,25,26)/p-1/t19-,20-/m1/s1
C22H30NO4372.47841100

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