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Found 50 results

Search term: MF = 'C_{21}H_{21}Cl_{3}N_{2}O_{5}'
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4029001
InChI=1/C21H21Cl3N2O5/c1-2-9-26(11-19(27)25-18-10-15(23)5-8-17(18)24)20(28)12-31-21(29)13-30-16-6-3-14(22)4-7-16/h3-8,10H,2,9,11-13H2,1H3,(H,25,27)
C21H21Cl3N2O5487.7608413800
10881264

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H19Cl3N2O.C2H2O4/c1-11(19(25)24-18-10-15(21)14(20)9-16(18)22)23-17-8-4-6-12-5-2-3-7-13(12)17;3-1(4)2(5)6/h2-3,5,7,9-11,17,23H,4,6,8H2,1H3,(H,24,25);(H,3,4)(H,5,6)
C21H21Cl3N2O5487.760810800
4484176
InChI=1/C21H21Cl3N2O5/c22-15-8-5-4-7-14(15)20(29)26-21(30)25-13-11-16(23)19(17(24)12-13)31-10-6-2-1-3-9-18(27)28/h4-5,7-8,11-12H,1-3,6,9-10H2,(H,27,28)(H2,25,26,29,30)
C21H21Cl3N2O5487.76088800
21994880

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H21Cl3N2O5/c1-13(31-20(27)12-30-19-11-17(23)16(22)10-18(19)24)21(28)25-14-2-4-15(5-3-14)26-6-8-29-9-7-26/h2-5,10-11,13H,6-9,12H2,1H3,(H,25,28)
C21H21Cl3N2O5487.76084200
33132416
InChI=1/C21H21Cl3N2O5/c1-3-26(4-2)21(29)13-6-5-7-14(8-13)25-19(27)11-31-20(28)12-30-18-10-16(23)15(22)9-17(18)24/h5-10H,3-4,11-12H2,1-2H3,(H,25,27)
C21H21Cl3N2O5487.76082200
62495337

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H21Cl3N2O5/c1-11(2)30-14-6-4-13(5-7-14)21(29)25-10-19(27)31-12(3)20(28)26-18-9-16(23)15(22)8-17(18)24/h4-9,11-12H,10H2,1-3H3,(H,25,29)(H,26,28)/t12-/m1/s1
C21H21Cl3N2O5487.76082200
66514970

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H21Cl3N2O5/c1-29-18-9-16(19(30-2)8-15(18)24)25-21(28)12-5-6-26(10-12)20(27)11-31-17-4-3-13(22)7-14(17)23/h3-4,7-9,12H,5-6,10-11H2,1-2H3,(H,25,28)
C21H21Cl3N2O5487.76082100
66521865

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H21Cl3N2O5/c1-29-16-9-15(17(30-2)8-14(16)24)25-20(27)11-6-7-26(10-11)21(28)18-12(22)4-5-13(23)19(18)31-3/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,25,27)
C21H21Cl3N2O5487.76082100
70057631
InChI=1/C21H21Cl3N2O5/c1-3-26(4-2)21(29)13-5-7-14(8-6-13)25-19(27)11-31-20(28)12-30-18-10-16(23)15(22)9-17(18)24/h5-10H,3-4,11-12H2,1-2H3,(H,25,27)
C21H21Cl3N2O5487.76081100
79570700

Double-bond stereo
InChI=1/C21H21Cl3N2O5/c1-21(30-5-6-31-21)10-19(27)26-25-11-13-7-17(24)20(18(8-13)28-2)29-12-14-3-4-15(22)9-16(14)23/h3-4,7-9,11H,5-6,10,12H2,1-2H3,(H,26,27)/b25-11+
C21H21Cl3N2O5487.76081100
99769358

Double-bond stereo
InChI=1/C21H21Cl3N2O5/c22-15-10-17(23)21(18(24)11-15)31-13-19(27)26-25-12-14-3-1-4-16(9-14)28-8-5-20-29-6-2-7-30-20/h1,3-4,9-12,20H,2,5-8,13H2,(H,26,27)/b25-12-
C21H21Cl3N2O5487.76081100
99769443

Double-bond stereo
InChI=1/C21H21Cl3N2O5/c22-15-10-17(23)21(18(24)11-15)31-13-19(27)26-25-12-14-2-4-16(5-3-14)28-9-6-20-29-7-1-8-30-20/h2-5,10-12,20H,1,6-9,13H2,(H,26,27)/b25-12-
C21H21Cl3N2O5487.76081100
99769452

Double-bond stereo
InChI=1/C21H21Cl3N2O5/c1-2-29-20(28)7-4-8-30-16-6-3-5-14(9-16)12-25-26-19(27)13-31-21-17(23)10-15(22)11-18(21)24/h3,5-6,9-12H,2,4,7-8,13H2,1H3,(H,26,27)/b25-12-
C21H21Cl3N2O5487.76081100
99769523

Double-bond stereo
InChI=1/C21H21Cl3N2O5/c1-2-29-20(28)4-3-9-30-16-7-5-14(6-8-16)12-25-26-19(27)13-31-21-17(23)10-15(22)11-18(21)24/h5-8,10-12H,2-4,9,13H2,1H3,(H,26,27)/b25-12-
C21H21Cl3N2O5487.76081100
101729136

Double-bond stereo
InChI=1/C21H21Cl3N2O5/c1-3-29-19-10-14(9-17(24)21(19)31-13(2)27)12-25-26-20(28)5-4-8-30-18-7-6-15(22)11-16(18)23/h6-7,9-12H,3-5,8H2,1-2H3,(H,26,28)/b25-12-
C21H21Cl3N2O5487.76081100
102674561

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H21Cl3N2O5/c1-4-29-18-9-13(8-17(24)19(18)31-12(3)21(28)30-5-2)11-25-26-20(27)15-7-6-14(22)10-16(15)23/h6-12H,4-5H2,1-3H3,(H,26,27)/b25-11-
C21H21Cl3N2O5487.76081100
108645072

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H21Cl3N2O5/c1-2-3-4-5-6-18(21(28)29)25(19-16(23)11-14(22)12-17(19)24)20(27)13-7-9-15(10-8-13)26(30)31/h7-12,18H,2-6H2,1H3,(H,28,29)
C21H21Cl3N2O5487.76081100
121114554

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H21Cl3N2O5/c1-11(2)12-3-5-13(6-4-12)31-17(28)9-25-20(29)16(10-27)26-21(30)18-14(22)7-8-15(23)19(18)24/h3-8,11,16,27H,9-10H2,1-2H3,(H,25,29)(H,26,30)
C21H21Cl3N2O5487.76081100
126148480

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H21Cl3N2O5/c1-26-18(27)7-11(21(28)25-15-9-13(23)12(22)8-14(15)24)19(26)10-5-16(29-2)20(31-4)17(6-10)30-3/h5-6,8-9,11,19H,7H2,1-4H3,(H,25,28)
C21H21Cl3N2O5487.76081100
126150231

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H21Cl3N2O5/c1-26-17(27)7-11(21(28)25-15-9-13(23)12(22)8-14(15)24)18(26)10-5-6-16(29-2)20(31-4)19(10)30-3/h5-6,8-9,11,18H,7H2,1-4H3,(H,25,28)
C21H21Cl3N2O5487.76081100
123

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