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 3 results

Search term: CQLWCUKHRZSMSZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2545005

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H22N6O6/c27-19(21-13-5-9-15(10-6-13)25(29)30)23-17-3-1-2-4-18(17)24-20(28)22-14-7-11-16(12-8-14)26(31)32/h5-12,17-18H,1-4H2,(H2,21,23,27)(H2,22,24,28)
C20H22N6O6442.425314800
9387954

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H22N6O6/c27-19(21-13-5-9-15(10-6-13)25(29)30)23-17-3-1-2-4-18(17)24-20(28)22-14-7-11-16(12-8-14)26(31)32/h5-12,17-18H,1-4H2,(H2,21,23,27)(H2,22,24,28)/t17-,18-/m1/s1
C20H22N6O6442.42532100
9616947

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H22N6O6/c27-19(21-13-5-9-15(10-6-13)25(29)30)23-17-3-1-2-4-18(17)24-20(28)22-14-7-11-16(12-8-14)26(31)32/h5-12,17-18H,1-4H2,(H2,21,23,27)(H2,22,24,28)/t17-,18-/m0/s1
C20H22N6O6442.42532100

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