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
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Found 7 results

Search term: BXBMBQJCCAMTQV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4045180

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3/b10-9-
C9H12N2O4S2276.3325811900
5954744

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3/b10-9-/t7-,8-/m1/s1
C9H12N2O4S2276.33262100
5954748

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3/b10-9-/t7-,8+/m0/s1
C9H12N2O4S2276.33262100
5954749

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3/b10-9-/t7-,8+/m1/s1
C9H12N2O4S2276.33262100
5954752

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3/b10-9-/t7-,8-/m0/s1
C9H12N2O4S2276.33262100
68016783

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3
C9H12N2O4S2276.33261100
109948035

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H12N2O4S2/c1-5(12)10-9-11(6(2)13)7-3-17(14,15)4-8(7)16-9/h7-8H,3-4H2,1-2H3/b10-9+
C9H12N2O4S2276.33261100

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