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: XUJHWEXMYDHYJT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5047463

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C23H19ClN2O6/c1-31-23(28)21-19(15-11-14(26(29)30)7-8-16(15)24)20-17(27)9-13(10-18(20)32-22(21)25)12-5-3-2-4-6-12/h2-8,11,13,19H,9-10,25H2,1H3
C23H19ClN2O6454.859811800
1034571

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C23H19ClN2O6/c1-31-23(28)21-19(15-11-14(26(29)30)7-8-16(15)24)20-17(27)9-13(10-18(20)32-22(21)25)12-5-3-2-4-6-12/h2-8,11,13,19H,9-10,25H2,1H3/t13-,19-/m1/s1
C23H19ClN2O6454.85983200
1034573

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C23H19ClN2O6/c1-31-23(28)21-19(15-11-14(26(29)30)7-8-16(15)24)20-17(27)9-13(10-18(20)32-22(21)25)12-5-3-2-4-6-12/h2-8,11,13,19H,9-10,25H2,1H3/t13-,19+/m0/s1
C23H19ClN2O6454.85983200
1034574

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C23H19ClN2O6/c1-31-23(28)21-19(15-11-14(26(29)30)7-8-16(15)24)20-17(27)9-13(10-18(20)32-22(21)25)12-5-3-2-4-6-12/h2-8,11,13,19H,9-10,25H2,1H3/t13-,19-/m0/s1
C23H19ClN2O6454.85982100
1034572

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C23H19ClN2O6/c1-31-23(28)21-19(15-11-14(26(29)30)7-8-16(15)24)20-17(27)9-13(10-18(20)32-22(21)25)12-5-3-2-4-6-12/h2-8,11,13,19H,9-10,25H2,1H3/t13-,19+/m1/s1
C23H19ClN2O6454.85982100

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