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: XONCOGODBGJANF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2269093

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H25N5O3/c1-2-29-17-6-4-16(5-7-17)26-19(27)14-18(20(26)28)24-15-8-12-25(13-9-15)21-22-10-3-11-23-21/h3-7,10-11,15,18,24H,2,8-9,12-14H2,1H3
C21H25N5O3395.4549221900
5668168

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H25N5O3/c1-2-29-17-6-4-16(5-7-17)26-19(27)14-18(20(26)28)24-15-8-12-25(13-9-15)21-22-10-3-11-23-21/h3-7,10-11,15,18,24H,2,8-9,12-14H2,1H3/t18-/m0/s1
C21H25N5O3395.45492100
5668170

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H25N5O3/c1-2-29-17-6-4-16(5-7-17)26-19(27)14-18(20(26)28)24-15-8-12-25(13-9-15)21-22-10-3-11-23-21/h3-7,10-11,15,18,24H,2,8-9,12-14H2,1H3/t18-/m1/s1
C21H25N5O3395.45492100
5668169

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H25N5O3/c1-2-29-17-6-4-16(5-7-17)26-19(27)14-18(20(26)28)24-15-8-12-25(13-9-15)21-22-10-3-11-23-21/h3-7,10-11,15,18,24H,2,8-9,12-14H2,1H3/p+1/t18-/m1/s1
C21H26N5O3396.46231100
5668167

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H25N5O3/c1-2-29-17-6-4-16(5-7-17)26-19(27)14-18(20(26)28)24-15-8-12-25(13-9-15)21-22-10-3-11-23-21/h3-7,10-11,15,18,24H,2,8-9,12-14H2,1H3/p+1/t18-/m0/s1
C21H26N5O3396.46231100

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