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 5 results

Search term: NJADQPPBRWNSRC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4097754

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C20H23ClN2O5/c21-16-2-1-14(23(27)28)6-15(16)17(7-18(24)25)22-19(26)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6,11-13,17H,3-5,7-10H2,(H,22,26)(H,24,25)
C20H23ClN2O5406.86002161100
5648332

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C20H23ClN2O5/c21-16-2-1-14(23(27)28)6-15(16)17(7-18(24)25)22-19(26)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6,11-13,17H,3-5,7-10H2,(H,22,26)(H,24,25)/t11?,12?,13?,17-,20?/m1/s1
C20H23ClN2O5406.862100
5648334

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C20H23ClN2O5/c21-16-2-1-14(23(27)28)6-15(16)17(7-18(24)25)22-19(26)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6,11-13,17H,3-5,7-10H2,(H,22,26)(H,24,25)/t11?,12?,13?,17-,20?/m0/s1
C20H23ClN2O5406.862100
5648333

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C20H23ClN2O5/c21-16-2-1-14(23(27)28)6-15(16)17(7-18(24)25)22-19(26)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6,11-13,17H,3-5,7-10H2,(H,22,26)(H,24,25)/p-1/t11?,12?,13?,17-,20?/m0/s1
C20H22ClN2O5405.85261100
5648331

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C20H23ClN2O5/c21-16-2-1-14(23(27)28)6-15(16)17(7-18(24)25)22-19(26)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6,11-13,17H,3-5,7-10H2,(H,22,26)(H,24,25)/p-1/t11?,12?,13?,17-,20?/m1/s1
C20H22ClN2O5405.85261100

Advertisement