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 5 results

Search term: KVUFQIHEKHMFOT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2790332

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H25N3O4/c1-28-18-8-6-16(7-9-18)23-10-12-24(13-11-23)20-15-21(26)25(22(20)27)17-4-3-5-19(14-17)29-2/h3-9,14,20H,10-13,15H2,1-2H3
C22H25N3O4395.4516231300
1255200

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O4/c1-28-18-8-6-16(7-9-18)23-10-12-24(13-11-23)20-15-21(26)25(22(20)27)17-4-3-5-19(14-17)29-2/h3-9,14,20H,10-13,15H2,1-2H3/t20-/m0/s1
C22H25N3O4395.45162100
1255201

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O4/c1-28-18-8-6-16(7-9-18)23-10-12-24(13-11-23)20-15-21(26)25(22(20)27)17-4-3-5-19(14-17)29-2/h3-9,14,20H,10-13,15H2,1-2H3/t20-/m1/s1
C22H25N3O4395.45162100
5356799

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O4/c1-28-18-8-6-16(7-9-18)23-10-12-24(13-11-23)20-15-21(26)25(22(20)27)17-4-3-5-19(14-17)29-2/h3-9,14,20H,10-13,15H2,1-2H3/p+1/t20-/m0/s1
C22H26N3O4396.4591100
5356800

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O4/c1-28-18-8-6-16(7-9-18)23-10-12-24(13-11-23)20-15-21(26)25(22(20)27)17-4-3-5-19(14-17)29-2/h3-9,14,20H,10-13,15H2,1-2H3/p+1/t20-/m1/s1
C22H26N3O4396.4591100

Advertisement