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 7 results

Search term: KTCLSQQHLVLHNU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7874738

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)/b13-6+
C11H11N3O3S2297.3533171100
12534804

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)/b13-6-
C11H11N3O3S2297.353312900
4405698

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)
C11H11N3O3S2297.353346300
4537643

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)/b13-6-/t8-/m1/s1
C11H11N3O3S2297.35332100
4593943

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)/b13-6-/t8-/m0/s1
C11H11N3O3S2297.35332100
5603223

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)/p-1/b13-6-/t8-/m1/s1
C11H10N3O3S2296.34592200
5603225

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H11N3O3S2/c1-6(7-3-2-4-18-7)13-14-11-12-9(15)5-8(19-11)10(16)17/h2-4,8H,5H2,1H3,(H,16,17)(H,12,14,15)/p-1/b13-6-/t8-/m0/s1
C11H10N3O3S2296.34591100

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