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 7 results

Search term: NHDHVHZZCFYRSB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
82851

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3
C20H19NO3321.369810732100
8120587

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/t16-/m0/s1
C20H19NO3321.36985200
30773530

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/i5D,6D,9D,14D
C20H15D4NO3325.39444500
94269864

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/i1D3,15D2,16D
C20H13D6NO3327.40673200
32787609

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/t16-/m1/s1
C20H19NO3321.36982100
71047889

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/i2+2,3+2,4+2,7+2,8+2,10+2,11+2,12+2,13+2,17+2,18+2,19+2
C814C12H19NO3345.28031100
71048040

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/i14+2
C1914CH19NO3323.36231100

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