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
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Found 20 results

Search term: GWFOVSGRNGAGDL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
54782

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7-/m1/s1
C11H15N5O3265.2685666100
18714460

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7-/m0/s1
C11H15N5O3265.268581100
8374683

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7+/m1/s1
C11H15N5O3265.26855500
10630778

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)
C11H15N5O3265.268543900
48060149

2 of 3 defined stereocentres - 2/3 defined

Non-standard isotope
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5?,6-,7+/m0/s1/i2D2,3D2
C11H11D4N5O3269.29314400
48060318

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5?,6-,7+/m0/s1
C11H15N5O3265.26854400
62661250

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7+/m0/s1
C11H15N5O3265.26852200
115015233

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7-/m0/s1/i4T
C11H14TN5O3267.27662200
115284870

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7-/m1/s1/i4T
C11H14TN5O3267.27662200
4891084

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6+,7+/m0/s1
C11H15N5O3265.26852100
5289336

0 of 3 defined stereocentres - 0/3 defined

Non-standard isotope
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/i4T
C11H14TN5O3267.2766092200
23128407

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6?,7?/m1/s1
C11H15N5O3265.26852200
23128427

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6-,7?/m0/s1
C11H15N5O3265.26852200
24685050

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6?,7-/m1/s1
C11H15N5O3265.26852200
68026274

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5?,6-,7+/m1/s1
C11H15N5O3265.26851100
74108720

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5?,6?,7-/m1/s1
C11H15N5O3265.26851100
76897401

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6+,7-/m1/s1
C11H15N5O3265.26851100
76920422

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C11H15N5O3/c12-11-14-9-8(10(19)15-11)13-4-16(9)7-1-5(2-17)6(7)3-18/h4-7,17-18H,1-3H2,(H3,12,14,15,19)/t5-,6+,7-/m1/s1/i2D2,3D2
C11H11D4N5O3269.29311100

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