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 4 results

Search term: NPFLXLYQVOPDPA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21367547

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C23H31N3O5/c1-14(2)9-18(23(29)24-16-5-3-4-6-16)25-22(28)15-10-21(27)26(12-15)17-7-8-19-20(11-17)31-13-30-19/h7-8,11,14-16,18H,3-6,9-10,12-13H2,1-2H3,(H,24,29)(H,25,28)/t15?,18-/m0/s1
C23H31N3O5429.509312900
4155563

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C23H31N3O5/c1-14(2)9-18(23(29)24-16-5-3-4-6-16)25-22(28)15-10-21(27)26(12-15)17-7-8-19-20(11-17)31-13-30-19/h7-8,11,14-16,18H,3-6,9-10,12-13H2,1-2H3,(H,24,29)(H,25,28)
C23H31N3O5429.509342100
6332224

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C23H31N3O5/c1-14(2)9-18(23(29)24-16-5-3-4-6-16)25-22(28)15-10-21(27)26(12-15)17-7-8-19-20(11-17)31-13-30-19/h7-8,11,14-16,18H,3-6,9-10,12-13H2,1-2H3,(H,24,29)(H,25,28)/t15-,18+/m1/s1
C23H31N3O5429.50932100
6332225

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C23H31N3O5/c1-14(2)9-18(23(29)24-16-5-3-4-6-16)25-22(28)15-10-21(27)26(12-15)17-7-8-19-20(11-17)31-13-30-19/h7-8,11,14-16,18H,3-6,9-10,12-13H2,1-2H3,(H,24,29)(H,25,28)/t15-,18-/m0/s1
C23H31N3O5429.50932100

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