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
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Found 9 results

Search term: KKJGAZRIFJEPKA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5485826

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/t20-,21+/m1/s1
C21H21NO303.3975563600
2037370

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/t20-,21+/m0/s1
C21H21NO303.39754513600
193175

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2
C21H21NO303.3975343300
5564688

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/t20-,21-/m0/s1
C21H21NO303.39759700
5564686

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/t20-,21-/m1/s1
C21H21NO303.39752100
5564687

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/p+1/t20-,21-/m0/s1
C21H22NO304.40491100
5485823

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/p+1/t20-,21+/m0/s1
C21H22NO304.40491100
5485825

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/p+1/t20-,21+/m1/s1
C21H22NO304.40491100
5564685

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H21NO/c23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-16-17-10-4-1-5-11-17/h1-15,20-23H,16H2/p+1/t20-,21-/m1/s1
C21H22NO304.40491100

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