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 7 results

Search term: VMRACLSWOUZLOP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4503735

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)/b20-18+
C22H21NO5379.4058161300
2155930

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)
C22H21NO5379.405843200
4564735

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)/b20-18+/t19-/m0/s1
C22H21NO5379.40582100
4564736

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)/b20-18+/t19-/m1/s1
C22H21NO5379.40582100
4871373

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)/b20-18-
C22H21NO5379.40582100
5339010

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)/p-1/b20-18+/t19-/m0/s1
C22H20NO5378.39841100
5339011

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H21NO5/c1-14-9-11-16(12-10-14)20(26)18-19(15-6-3-2-4-7-15)23(22(28)21(18)27)13-5-8-17(24)25/h2-4,6-7,9-12,19,26H,5,8,13H2,1H3,(H,24,25)/p-1/b20-18+/t19-/m1/s1
C22H20NO5378.39841100

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