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 5 results

Search term: JYRQQKIOHWOXDX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3757470

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H35NO3/c1-16(2)21(10-12-25-20(3,4)15-21)9-11-22-14-17-7-8-18(23-5)19(13-17)24-6/h7-8,13,16,22H,9-12,14-15H2,1-6H3
C21H35NO3349.5075171300
1386466

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H35NO3/c1-16(2)21(10-12-25-20(3,4)15-21)9-11-22-14-17-7-8-18(23-5)19(13-17)24-6/h7-8,13,16,22H,9-12,14-15H2,1-6H3/t21-/m0/s1
C21H35NO3349.50752100
1386468

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H35NO3/c1-16(2)21(10-12-25-20(3,4)15-21)9-11-22-14-17-7-8-18(23-5)19(13-17)24-6/h7-8,13,16,22H,9-12,14-15H2,1-6H3/t21-/m1/s1
C21H35NO3349.50752100
1386465

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H35NO3/c1-16(2)21(10-12-25-20(3,4)15-21)9-11-22-14-17-7-8-18(23-5)19(13-17)24-6/h7-8,13,16,22H,9-12,14-15H2,1-6H3/p+1/t21-/m0/s1
C21H36NO3350.51491100
1386467

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H35NO3/c1-16(2)21(10-12-25-20(3,4)15-21)9-11-22-14-17-7-8-18(23-5)19(13-17)24-6/h7-8,13,16,22H,9-12,14-15H2,1-6H3/p+1/t21-/m1/s1
C21H36NO3350.51491100

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