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 4 results

Search term: NXFMCYFCLKPNML (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
12990665

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C9H14N2O4S3/c10-9-11(6-1-2-17(12,13)3-6)7-4-18(14,15)5-8(7)16-9/h6-8,10H,1-5H2
C9H14N2O4S3310.41353300
10058187

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H14N2O4S3/c10-9-11(6-1-2-17(12,13)3-6)7-4-18(14,15)5-8(7)16-9/h6-8,10H,1-5H2/b10-9-/t6-,7-,8+/m1/s1
C9H14N2O4S3310.41352100
10058188

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H14N2O4S3/c10-9-11(6-1-2-17(12,13)3-6)7-4-18(14,15)5-8(7)16-9/h6-8,10H,1-5H2/b10-9-/t6-,7+,8-/m0/s1
C9H14N2O4S3310.41352100
17576233

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C9H14N2O4S3/c10-9-11(6-1-2-17(12,13)3-6)7-4-18(14,15)5-8(7)16-9/h6-8,10H,1-5H2/b10-9-
C9H14N2O4S3310.41351100

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