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: CMQAUGMSLZEXFP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2405857

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O4/c1-8(16)14-10-2-4-11(5-3-10)15-7-9(13(18)19)6-12(15)17/h2-5,9H,6-7H2,1H3,(H,14,16)(H,18,19)
C13H14N2O4262.2613473400
5023762

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-8(16)14-10-2-4-11(5-3-10)15-7-9(13(18)19)6-12(15)17/h2-5,9H,6-7H2,1H3,(H,14,16)(H,18,19)/t9-/m0/s1
C13H14N2O4262.26132100
679996

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-8(16)14-10-2-4-11(5-3-10)15-7-9(13(18)19)6-12(15)17/h2-5,9H,6-7H2,1H3,(H,14,16)(H,18,19)/t9-/m1/s1
C13H14N2O4262.26132100
5315775

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-8(16)14-10-2-4-11(5-3-10)15-7-9(13(18)19)6-12(15)17/h2-5,9H,6-7H2,1H3,(H,14,16)(H,18,19)/p-1/t9-/m1/s1
C13H13N2O4261.253321100
5406941

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-8(16)14-10-2-4-11(5-3-10)15-7-9(13(18)19)6-12(15)17/h2-5,9H,6-7H2,1H3,(H,14,16)(H,18,19)/p-1/t9-/m0/s1
C13H13N2O4261.25391100
3308834

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O4/c1-8(16)14-10-2-4-11(5-3-10)15-7-9(13(18)19)6-12(15)17/h2-5,9H,6-7H2,1H3,(H,14,16)(H,18,19)/p-1
C13H13N2O4261.25391100

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