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 9 results

Search term: HIQDDHGPEOKZTG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2426506

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)
C22H29N7O2423.51149400
972589

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/t17-,20+/m1/s1
C22H29N7O2423.51142100
972590

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/t17-,20-/m1/s1
C22H29N7O2423.51142100
972591

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/t17-,20-/m0/s1
C22H29N7O2423.51142100
972592

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/t17-,20+/m0/s1
C22H29N7O2423.51142100
5341399

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/p+2/t17-,20+/m1/s1
C22H31N7O2425.52611100
5341400

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/p+2/t17-,20-/m1/s1
C22H31N7O2425.52611100
5341401

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/p+2/t17-,20-/m0/s1
C22H31N7O2425.52611100
5341402

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H29N7O2/c1-15-5-3-6-16-13-18(22(30)23-19(15)16)20(28-10-8-27(2)9-11-28)21-24-25-26-29(21)14-17-7-4-12-31-17/h3,5-6,13,17,20H,4,7-12,14H2,1-2H3,(H,23,30)/p+2/t17-,20+/m0/s1
C22H31N7O2425.52611100

Advertisement