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 12 results

Search term: KUCQYCKVKVOKAY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10482034


2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15-
C22H19ClO3366.83759711863113
10619298

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2
C22H19ClO3366.83753937700
21258076

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15?
C22H19ClO3366.837514661113
38772299

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15-/i1D,2D,3D,4D
C22H15D4ClO3370.8621111000
57579856

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15+
C22H19ClO3366.83757500
94270013

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15-/i9D,10D,11D,12D
C22H15D4ClO3370.86216600
48059633

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15-/i7D2,8D2,15D
C22H14D5ClO3371.86835800
23976663

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15+/i7D2,8D2,15D
C22H14D5ClO3371.86833200
58793452

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/i1D,2D,3D,4D
C22H15D4ClO3370.86211100
44211244

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/i9D,10D,11D,12D
C22H15D4ClO3370.86211100
115009527

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15+/i1D,2D,3D,4D
C22H15D4ClO3370.86211100

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