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 21 results

Search term: WDDPHFBMKLOVOX (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
106472

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6-,9-/m1/s1
C10H11ClFN5O3303.677412212610
314789

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)
C10H11ClFN5O3303.6774177100
8058578

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4-,6-,9-/m1/s1
C10H11ClFN5O3303.67749500
21396058

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6+,9-/m1/s1
C10H11ClFN5O3303.67747600
409942

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6-,9-/m0/s1
C10H11ClFN5O3303.67746300
21240773

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6-,9+/m0/s1
C10H11ClFN5O3303.67746400
21475138

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4-,6?,9-/m1/s1
C10H11ClFN5O3303.67744400
29786933

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6?,9-/m1/s1
C10H11ClFN5O3303.67744400
58842076

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6-,9+/m1/s1
C10H11ClFN5O3303.67743300
62378055

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4-,6+,9+/m0/s1
C10H11ClFN5O3303.67742200
62655033

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6+,9-/m0/s1
C10H11ClFN5O3303.67742200
8170752

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4-,6-,9+/m1/s1
C10H11ClFN5O3303.67742100
32770059

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6-,9?/m1/s1
C10H11ClFN5O3303.67741100
58780735

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6+,9-/m1/s1/i10+1,13+1,15+1,16+1
C913CH11ClFN215N3O3307.65031100
58780736

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6+,9+/m1/s1/i10+1,13+1,15+1,16+1
C913CH11ClFN215N3O3307.65031100
58781431

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6+,9+/m1/s1
C10H11ClFN5O3303.67741100
114391290

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4-,6-,9+/m0/s1
C10H11ClFN5O3303.67741100
114394232

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6+,9-/m1/s1/i2+2
C914CH11ClFN5O3305.671100
114394395

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4?,6+,9-/m1/s1/i2T
C10H10TClFN5O3305.68561100
128924441

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6+,9-/m1/s1
C10H11ClFN5O3303.67741100
12

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