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: DAHGMKXJUHOBPI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
11968678

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H17N5O/c1-4-11(3)22-14(19)12(9-18)8-13-16(22)20-15-10(2)6-5-7-21(15)17(13)23/h5-8,11,19H,4H2,1-3H3
C17H17N5O307.3498252000
2403583

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H17N5O/c1-4-11(3)22-14(19)12(9-18)8-13-16(22)20-15-10(2)6-5-7-21(15)17(13)23/h5-8,11,19H,4H2,1-3H3/b19-14+
C17H17N5O307.34985300
3330326

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H17N5O/c1-4-11(3)22-14(19)12(9-18)8-13-16(22)20-15-10(2)6-5-7-21(15)17(13)23/h5-8,11,19H,4H2,1-3H3/p+1
C17H18N5O308.35722100
5299038

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H17N5O/c1-4-11(3)22-14(19)12(9-18)8-13-16(22)20-15-10(2)6-5-7-21(15)17(13)23/h5-8,11,19H,4H2,1-3H3/p+1/t11-/m1/s1
C17H18N5O308.357722100
5299039

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H17N5O/c1-4-11(3)22-14(19)12(9-18)8-13-16(22)20-15-10(2)6-5-7-21(15)17(13)23/h5-8,11,19H,4H2,1-3H3/p+1/t11-/m0/s1
C17H18N5O308.357722100

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