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 8 results

Search term: SEQDDYPDSLOBDC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5198

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3
C16H13ClN2O2300.739674121776030
27523923

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/i2D,3D,4D,5D,6D
C16H8D5ClN2O2305.7704132300
68003790

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/i1D3,2D,3D,4D,5D,6D
C16H5D8ClN2O2308.78899700
34989648

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/t15-/m1/s1
C16H13ClN2O2300.73965800
48062846

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/i1+1D3
C1513CH10D3ClN2O2304.75085700
21240721

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/t15-/m0/s1
C16H13ClN2O2300.73964400
78057675

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/i1D3
C16H10D3ClN2O2303.75811100
95661223

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3/i20D
C16H12DClN2O2301.74581100

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