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 14 results

Search term: OKZXFIFRXLDNKI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4647391

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1+
C12H14N2O7298.24889400
2056428

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)
C12H14N2O7298.248763100
5503064

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1+/t7-,9+,11+/m1/s1
C12H14N2O7298.24882100
5503066

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1+/t7-,9+,11-/m1/s1
C12H14N2O7298.24882100
21473708

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1-
C12H14N2O7298.24882100
5306114

Charge

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/p-1/b2-1+/t7-,9-,11-/m0/s1
C12H13N2O7297.240822300
5306115

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1+/t7-,9-,11-/m0/s1
C12H14N2O7298.248762100
5503060

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1+/t7-,9-,11+/m1/s1
C12H14N2O7298.24882100
5503062

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/b2-1+/t7-,9-,11-/m1/s1
C12H14N2O7298.24882100
5503063

Charge

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/p-1/b2-1+/t7-,9+,11+/m1/s1
C12H13N2O7297.24141100
5503061

Charge

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/p-1/b2-1+/t7-,9-,11-/m1/s1
C12H13N2O7297.24141100
5503059

Charge

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/p-1/b2-1+/t7-,9-,11+/m1/s1
C12H13N2O7297.24141100
24816952

Charge

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/p-1
C12H13N2O7297.24141100
5503065

Charge

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N2O7/c15-4-7-5-21-11(9(7)18)14-3-6(1-2-8(16)17)10(19)13-12(14)20/h1-3,7,9,11,15,18H,4-5H2,(H,16,17)(H,13,19,20)/p-1/b2-1+/t7-,9+,11-/m1/s1
C12H13N2O7297.24141100

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