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: CXTVMTJNGWUDIS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2461595

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C26H28N6/c1-4-10-22(11-5-1)16-17-32-26(27-28-29-32)25(23-12-6-2-7-13-23)31-20-18-30(19-21-31)24-14-8-3-9-15-24/h1-15,25H,16-21H2
C26H28N6424.540712700
1197138

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C26H28N6/c1-4-10-22(11-5-1)16-17-32-26(27-28-29-32)25(23-12-6-2-7-13-23)31-20-18-30(19-21-31)24-14-8-3-9-15-24/h1-15,25H,16-21H2/t25-/m1/s1
C26H28N6424.54072100
1197139

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C26H28N6/c1-4-10-22(11-5-1)16-17-32-26(27-28-29-32)25(23-12-6-2-7-13-23)31-20-18-30(19-21-31)24-14-8-3-9-15-24/h1-15,25H,16-21H2/t25-/m0/s1
C26H28N6424.54072100
5714666

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C26H28N6/c1-4-10-22(11-5-1)16-17-32-26(27-28-29-32)25(23-12-6-2-7-13-23)31-20-18-30(19-21-31)24-14-8-3-9-15-24/h1-15,25H,16-21H2/p+1/t25-/m1/s1
C26H29N6425.54811100
5714667

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C26H28N6/c1-4-10-22(11-5-1)16-17-32-26(27-28-29-32)25(23-12-6-2-7-13-23)31-20-18-30(19-21-31)24-14-8-3-9-15-24/h1-15,25H,16-21H2/p+1/t25-/m0/s1
C26H29N6425.54811100

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