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 6 results

Search term: XKFRHUCZGRZHJO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2219432

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H23NO4S/c1-3-14-10-11-15(4-2)18(12-14)25(23,24)20-17(13-19(21)22)16-8-6-5-7-9-16/h5-12,17,20H,3-4,13H2,1-2H3,(H,21,22)
C19H23NO4S361.45522261900
1004251

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S/c1-3-14-10-11-15(4-2)18(12-14)25(23,24)20-17(13-19(21)22)16-8-6-5-7-9-16/h5-12,17,20H,3-4,13H2,1-2H3,(H,21,22)/t17-/m0/s1
C19H23NO4S361.45522100
1004252

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S/c1-3-14-10-11-15(4-2)18(12-14)25(23,24)20-17(13-19(21)22)16-8-6-5-7-9-16/h5-12,17,20H,3-4,13H2,1-2H3,(H,21,22)/t17-/m1/s1
C19H23NO4S361.45522100
2700527

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H23NO4S/c1-3-14-10-11-15(4-2)18(12-14)25(23,24)20-17(13-19(21)22)16-8-6-5-7-9-16/h5-12,17,20H,3-4,13H2,1-2H3,(H,21,22)/p-1
C19H22NO4S360.447281100
5343963

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S/c1-3-14-10-11-15(4-2)18(12-14)25(23,24)20-17(13-19(21)22)16-8-6-5-7-9-16/h5-12,17,20H,3-4,13H2,1-2H3,(H,21,22)/p-1/t17-/m0/s1
C19H22NO4S360.44781100
5343964

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S/c1-3-14-10-11-15(4-2)18(12-14)25(23,24)20-17(13-19(21)22)16-8-6-5-7-9-16/h5-12,17,20H,3-4,13H2,1-2H3,(H,21,22)/p-1/t17-/m1/s1
C19H22NO4S360.44781100

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