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 12 results

Search term: NAGHJYXWJQCCPK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
31047303

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9+,10-,11-/m1/s1
C13H16Cl3NO8420.627131100
30649245

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9+,10-,11+/m1/s1
C13H16Cl3NO8420.62712800
34451078

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9+,10-,11?/m1/s1
C13H16Cl3NO8420.6279700
23976433

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9?,10?,11-/m1/s1
C13H16Cl3NO8420.6278500
52563812

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9-,10+,11+/m0/s1
C13H16Cl3NO8420.6275500
24605840

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9+,10+,11+/m0/s1
C13H16Cl3NO8420.627043200
22378906

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3
C13H16Cl3NO8420.6273100
9157900

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/b17-12+/t8-,9-,10+,11?/m0/s1
C13H16Cl3NO8420.6272100
9277015

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/b17-12+/t8-,9+,10-,11?/m1/s1
C13H16Cl3NO8420.6272100
9297789

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/b17-12+/t8-,9+,10-,11-/m1/s1
C13H16Cl3NO8420.6272100
71116109

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9-,10?,11-/m1/s1
C13H16Cl3NO8420.6271100
74091121

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C13H16Cl3NO8/c1-5(18)22-8-4-21-11(25-12(17)13(14,15)16)10(24-7(3)20)9(8)23-6(2)19/h8-11,17H,4H2,1-3H3/t8-,9-,10+,11-/m1/s1
C13H16Cl3NO8420.6271100

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