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 6 results

Search term: WKVDSZYIGHLONN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
397698

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10ClFN2O4/c10-4-2-13(9(16)12-8(4)15)7-1-5(11)6(3-14)17-7/h2,5-7,14H,1,3H2,(H,12,15,16)/t5-,6+,7+/m0/s1
C9H10ClFN2O4264.6381444430
54713

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C9H10ClFN2O4/c10-4-2-13(9(16)12-8(4)15)7-1-5(11)6(3-14)17-7/h2,5-7,14H,1,3H2,(H,12,15,16)
C9H10ClFN2O4264.63817900
419177

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10ClFN2O4/c10-4-2-13(9(16)12-8(4)15)7-1-5(11)6(3-14)17-7/h2,5-7,14H,1,3H2,(H,12,15,16)/t5-,6+,7+/m1/s1
C9H10ClFN2O4264.63815400
8531043

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H10ClFN2O4/c10-4-2-13(9(16)12-8(4)15)7-1-5(11)6(3-14)17-7/h2,5-7,14H,1,3H2,(H,12,15,16)/t5-,6+,7+/m0/s1/i3T/t3?,5-,6+,7+
C9H9TClFN2O4266.64622200
16741442

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H10ClFN2O4/c10-4-2-13(9(16)12-8(4)15)7-1-5(11)6(3-14)17-7/h2,5-7,14H,1,3H2,(H,12,15,16)/t5?,6-,7-/m1/s1
C9H10ClFN2O4264.63812280
58784944

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10ClFN2O4/c10-4-2-13(9(16)12-8(4)15)7-1-5(11)6(3-14)17-7/h2,5-7,14H,1,3H2,(H,12,15,16)/t5-,6-,7-/m1/s1
C9H10ClFN2O4264.63811100

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