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: BAZVSMNPJJMILC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
37749

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3
C14H18ClN3O2295.76469617700
83435

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/t12-,13-/m0/s1
C14H18ClN3O2295.7646222100
84373

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/t12-,13+/m1/s1
C14H18ClN3O2295.7646161500
160804

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/t12-,13-/m1/s1
C14H18ClN3O2295.764612900
796471

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/t12-,13+/m0/s1
C14H18ClN3O2295.7646121400
30773533

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/i4D,5D,6D,7D
C14H14D4ClN3O2299.789391200
71047748

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/i4+2,5+2,6+2,7+2,10+2,11+2
C814C6H18ClN3O2307.71991100
95758324

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/i19D
C14H17DClN3O2296.77081100

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