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 6 results

Search term: JGPNMZWFVRQNGU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10441939

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H22Cl2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3
C16H22Cl2N2O329.2647131300
23113403

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H22Cl2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15-/m1/s1
C16H22Cl2N2O329.2647111600
68895008

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C16H22Cl2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15-/m1/s1/i1D3,2D3
C16H16D6Cl2N2O335.30176600
29409288

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H22Cl2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15-/m0/s1
C16H22Cl2N2O329.26474800
107447996

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C16H22Cl2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15-/m1/s1/i8D,9D,10D
C16H19D3Cl2N2O332.28323300
128926814

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C16H22Cl2N2O/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11/h8-10,14-15H,4-7H2,1-3H3/t14-,15+/m0/s1/i1D3,2D3
C16H16D6Cl2N2O335.30171100

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