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 6 results

Search term: QUAQHVLEEDCGSB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21339564

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H17N3O4S/c1-3-9(2)19-14(21)12(13(20)18-16(19)24)8-17-11-6-4-10(5-7-11)15(22)23/h4-9,17H,3H2,1-2H3,(H,22,23)(H,18,20,24)/b12-8+
C16H17N3O4S347.388910900
5195729

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H17N3O4S/c1-3-9(2)19-14(21)12(13(20)18-16(19)24)8-17-11-6-4-10(5-7-11)15(22)23/h4-9,17H,3H2,1-2H3,(H,22,23)(H,18,20,24)
C16H17N3O4S347.38894300
5782883

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-3-9(2)19-14(21)12(13(20)18-16(19)24)8-17-11-6-4-10(5-7-11)15(22)23/h4-9,17H,3H2,1-2H3,(H,22,23)(H,18,20,24)/b12-8+/t9-/m0/s1
C16H17N3O4S347.38892100
4617099

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-3-9(2)19-14(21)12(13(20)18-16(19)24)8-17-11-6-4-10(5-7-11)15(22)23/h4-9,17H,3H2,1-2H3,(H,22,23)(H,18,20,24)/p-1/b12-8+/t9-/m1/s1
C16H16N3O4S346.38152200
4894609

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-3-9(2)19-14(21)12(13(20)18-16(19)24)8-17-11-6-4-10(5-7-11)15(22)23/h4-9,17H,3H2,1-2H3,(H,22,23)(H,18,20,24)/b12-8+/t9-/m1/s1
C16H17N3O4S347.38892100
4617100

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H17N3O4S/c1-3-9(2)19-14(21)12(13(20)18-16(19)24)8-17-11-6-4-10(5-7-11)15(22)23/h4-9,17H,3H2,1-2H3,(H,22,23)(H,18,20,24)/p-1/b12-8+/t9-/m0/s1
C16H16N3O4S346.38151100

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