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 9 results

Search term: DUJGMZAICVPCBJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
65664

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8-,9+/m1/s1
C10H13N3O4239.2279282600
429335

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8-,9+/m0/s1
C10H13N3O4239.22796500
431756

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8-,9-/m1/s1
C10H13N3O4239.22795600
499373

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)
C10H13N3O4239.22795500
315221

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8?,9+/m1/s1
C10H13N3O4239.22793300
5145165

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8+,9+/m1/s1
C10H13N3O4239.22792100
23208473

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8?,9-/m1/s1
C10H13N3O4239.227922200
58842642

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8+,9-/m1/s1
C10H13N3O4239.22791100
107443855

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C10H13N3O4/c11-7-1-2-13(10(17)12-7)6-3-5(4-14)8(15)9(6)16/h1-3,6,8-9,14-16H,4H2,(H2,11,12,17)/t6-,8?,9?/m1/s1
C10H13N3O4239.22791100

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