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 5 results

Search term: KBAOXJSNMBNBHM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2400492

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H12ClNO2/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(16)17)12(8)15-11/h4-6,9,15H,1-3H2,(H,16,17)
C13H12ClNO2249.69288593500
5427833

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12ClNO2/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(16)17)12(8)15-11/h4-6,9,15H,1-3H2,(H,16,17)/t9-/m1/s1
C13H12ClNO2249.69297600
718703

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12ClNO2/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(16)17)12(8)15-11/h4-6,9,15H,1-3H2,(H,16,17)/t9-/m0/s1
C13H12ClNO2249.69292100
5320333

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12ClNO2/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(16)17)12(8)15-11/h4-6,9,15H,1-3H2,(H,16,17)/p-1/t9-/m0/s1
C13H11ClNO2248.684941100
5427832

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12ClNO2/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(16)17)12(8)15-11/h4-6,9,15H,1-3H2,(H,16,17)/p-1/t9-/m1/s1
C13H11ClNO2248.68551100

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