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: ZKFWBQZWZFPJSL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2122487

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3
C21H27NO309.44518251700
1381269

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3/t16-,21-/m0/s1
C21H27NO309.445212800
1067037

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3/t16-,21-/m1/s1
C21H27NO309.44522100
1274016

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3/p+1/t16-,21-/m1/s1
C21H28NO310.45261100
1381268

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3/p+1/t16-,21-/m0/s1
C21H28NO310.45261100
3653711

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3/p+1
C21H28NO310.453121100
95503998

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H27NO/c1-20(2)10-16-11-21(3,13-20)14-22(16)12-18-17-7-5-4-6-15(17)8-9-19(18)23/h4-9,16,23H,10-14H2,1-3H3/t16-,21+/m1/s1
C21H27NO309.44521100

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