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 864 results

Search term: C20H17F3N2O4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3243

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)
C20H17F3N2O4406.35527812600
11444963


InChI=1/C20H17F3N2O4/c1-24(12-9-7-11(8-10-12)20(21,22)23)18(27)16-17(26)15-13(25(2)19(16)28)5-4-6-14(15)29-3/h4-10,26H,1-3H3
C20H17F3N2O4406.3552618700
2131455

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17F3N2O4/c1-12-16(18(26)28-11-20(21,22)23)17(25-19(27)24-12)13-6-5-9-15(10-13)29-14-7-3-2-4-8-14/h2-10,17H,11H2,1H3,(H2,24,25,27)
C20H17F3N2O4406.3551896231700
1106005
InChI=1/C20H17F3N2O4/c1-11(2)10-25-18(27)15-8-3-12(9-16(15)19(25)28)17(26)24-13-4-6-14(7-5-13)29-20(21,22)23/h3-9,11H,10H2,1-2H3,(H,24,26)
C20H17F3N2O4406.3552211400
535380

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17F3N2O4/c1-29-15-9-7-13(8-10-15)12-24(19(28)20(21,22)23)16-11-17(26)25(18(16)27)14-5-3-2-4-6-14/h2-10,16H,11-12H2,1H3
C20H17F3N2O4406.3552191500
3622944

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17F3N2O4/c21-20(22,23)15-8-4-5-9-16(15)24-17(26)12-29-19(28)13-10-18(27)25(11-13)14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,24,26)
C20H17F3N2O4406.3551896181200
2924629
InChI=1/C20H17F3N2O4/c1-29-10-4-9-25-18(27)13-8-7-12(11-14(13)19(25)28)17(26)24-16-6-3-2-5-15(16)20(21,22)23/h2-3,5-8,11H,4,9-10H2,1H3,(H,24,26)
C20H17F3N2O4406.3551896161000
3259720

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17F3N2O4/c1-12-16(13(2)26)19(20(21,22)23,24-17(27)15-9-6-10-29-15)18(28)25(12)11-14-7-4-3-5-8-14/h3-10H,11H2,1-2H3,(H,24,27)
C20H17F3N2O4406.3552161100
10133036

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C20H17F3N2O4/c1-24-16(11-6-8-14(28-2)9-7-11)15-17(29-24)19(27)25(18(15)26)13-5-3-4-12(10-13)20(21,22)23/h3-10,15-17H,1-2H3/t15-,16-,17+/m1/s1
C20H17F3N2O4406.3552151200
2581624

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17F3N2O4/c21-20(22,23)13-1-3-14(4-2-13)24-19(27)12-9-18(26)25(11-12)15-5-6-16-17(10-15)29-8-7-28-16/h1-6,10,12H,7-9,11H2,(H,24,27)
C20H17F3N2O4406.3552151200
1606750

Double-bond stereo
InChI=1/C20H17F3N2O4/c1-27-16-8-12(9-17(28-2)18(16)29-3)7-13(11-24)19(26)25-15-6-4-5-14(10-15)20(21,22)23/h4-10H,1-3H3,(H,25,26)/b13-7+
C20H17F3N2O4406.3552151100
1606751

Double-bond stereo
InChI=1/C20H17F3N2O4/c1-27-16-8-12(9-17(28-2)18(16)29-3)7-13(11-24)19(26)25-15-6-4-5-14(10-15)20(21,22)23/h4-10H,1-3H3,(H,25,26)/b13-7-
C20H17F3N2O4406.355215900
1506237
InChI=1/C20H17F3N2O4/c1-3-29-19(27)17-16(14-10-13(28-2)7-8-15(14)24-17)25-18(26)11-5-4-6-12(9-11)20(21,22)23/h4-10,24H,3H2,1-2H3,(H,25,26)
C20H17F3N2O4406.3552141100
12545638
InChI=1/C20H17F3N2O4/c1-12-15(11-28-14-7-5-6-13(10-14)20(21,22)23)18(25-29-12)19(26)24-16-8-3-4-9-17(16)27-2/h3-10H,11H2,1-2H3,(H,24,26)
C20H17F3N2O4406.3552141000
12545712
InChI=1/C20H17F3N2O4/c1-12-17(11-28-16-5-3-4-13(10-16)20(21,22)23)18(25-29-12)19(26)24-14-6-8-15(27-2)9-7-14/h3-10H,11H2,1-2H3,(H,24,26)
C20H17F3N2O4406.3552141000
12545810
InChI=1/C20H17F3N2O4/c1-12-17(11-28-16-8-3-5-13(9-16)20(21,22)23)18(25-29-12)19(26)24-14-6-4-7-15(10-14)27-2/h3-10H,11H2,1-2H3,(H,24,26)
C20H17F3N2O4406.3552141000
26045454
InChI=1/C20H17F3N2O4/c1-27-17-8-6-14(11-18(17)28-2)16-7-9-19(26)25(24-16)12-13-4-3-5-15(10-13)29-20(21,22)23/h3-11H,12H2,1-2H3
C20H17F3N2O4406.355214900
18441559

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H17F3N2O4/c1-19-10-14(12-9-11(17(26)28-2)7-8-16(12)29-19)24-18(27)25(19)15-6-4-3-5-13(15)20(21,22)23/h3-9,14H,10H2,1-2H3,(H,24,27)
C20H17F3N2O4406.355212900
18441560

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H17F3N2O4/c1-19-10-15(14-8-11(17(26)28-2)6-7-16(14)29-19)24-18(27)25(19)13-5-3-4-12(9-13)20(21,22)23/h3-9,15H,10H2,1-2H3,(H,24,27)
C20H17F3N2O4406.355212900
1888388
InChI=1/C20H17F3N2O4/c21-20(22,23)15-4-1-2-5-16(15)24-17(26)12-29-19(28)13-7-9-14(10-8-13)25-11-3-6-18(25)27/h1-2,4-5,7-10H,3,6,11-12H2,(H,24,26)
C20H17F3N2O4406.355212900
12345

Advertisement