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 15 results

Search term: GFYLSDSUCHVORB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17216227

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7-,8-,11-/m1/s1
C11H15N5O4281.2679548011315
58122504

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7-,8-,11-/m0/s1
C11H15N5O4281.26799900
21490619

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3
C11H15N5O4281.26796300
25568

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/b12-9-/t5-,7-,8-,11-/m1/s1
C11H15N5O4281.26796500
228756

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/b12-9-
C11H15N5O4281.26794600
66424108

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7+,8-,11-/m1/s1
C11H15N5O4281.26793400
21171633

Double-bond stereo

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5?,7?,8?,11-/m1/s1
C11H15N5O4281.26793100
95542352

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7-,8-,11-/m1/s1/i1D3
C11H12D3N5O4284.28642400
5614821

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/p+1/t5-,7+,8+,11-/m0/s1
C11H16N5O4282.27532100
5614822

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/p+1/t5-,7+,8+,11+/m0/s1
C11H16N5O4282.27532100
35518677

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7+,8?,11-/m1/s1
C11H15N5O4281.26792300
17346979

Double-bond stereo

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/b12-9-/t5?,7?,8?,11-/m1/s1
C11H15N5O4281.26791100
98645094

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5?,7-,8-,11-/m1/s1
C11H15N5O4281.26791100
79536156

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/p+1/t5-,7-,8-,11-/m1/s1
C11H16N5O4282.27531100

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