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 7 results

Search term: WUFRNEJYZWHXLC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
15936

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/p-1/t7-,8-,9+;/m0./s1
C9H20ClNO2209.7136354000
13704596

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/p-1
C9H20ClNO2209.7136111000
19954667

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/p-1/t7-,8-,9+;/m1./s1
C9H20ClNO2209.713671000
9565076

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/p-1/t7-,8-,9-;/m0./s1
C9H20ClNO2209.71362100
17347000

Charge

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/t7?,8-,9?;/m0./s1
C9H21ClNO2210.7211100
107446229

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/p-1/t7-,8-,9-;/m1./s1
C9H20ClNO2209.71361600
115009569

Charge

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H20NO2.ClH/c1-7-9(11)5-8(12-7)6-10(2,3)4;/h7-9,11H,5-6H2,1-4H3;1H/q+1;/p-1/t7-,8-,9+;/m1./s1/i2D3,3D3,4D3;
C9H11D9ClNO2218.76911100

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