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 8 results

Search term: MFSWTRQUCLNFOM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
46141

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3
C16H13ClF3NO4375.72698810100
11677244

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/t9-/m1/s1
C16H13ClF3NO4375.7269696400
30647194

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/t9-/m0/s1
C16H13ClF3NO4375.726915900
58785137

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/i3D,4D,5D,6D
C16H9D4ClF3NO4379.75162400
103835467

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/t9-/m1/s1/i2D3
C16H10D3ClF3NO4378.74542600
71047682

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/i7+2,13+2
C1414C2H13ClF3NO4379.7121100
71048015

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/i7+2,10+2
C1414C2H13ClF3NO4379.7121100
71048078

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3/i5+2,12+2
C1414C2H13ClF3NO4379.7121100

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