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 13 results

Search term: XRDRXGVDCVQVPV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8167510

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)
C12H19NO4241.2836526600
24599125

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8+,9+/m1/s1
C12H19NO4241.2836472900
32806355

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8+,9+/m0/s1
C12H19NO4241.2836333700
34451004

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8-,9+/m0/s1
C12H19NO4241.2836252200
25027278

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7?,8-,9?/m0/s1
C12H19NO4241.2836221900
30648789

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8-,9+/m1/s1
C12H19NO4241.2836181000
58122499

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8-,9-/m0/s1
C12H19NO4241.28368800
34443414

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7?,8-,9?/m1/s1
C12H19NO4241.28367600
34982974

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8?,9+/m1/s1
C12H19NO4241.28363300
60699579

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7?,8-,9+/m0/s1
C12H19NO4241.28362200
34978530

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8+,9-/m0/s1
C12H19NO4241.28362200
114816656

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8-,9-/m1/s1
C12H19NO4241.28361100
60630103

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-7-4-5-9(13)8(6-7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8?,9+/m0/s1
C12H19NO4241.28361100

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