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
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Found 4058 results

Search term: C21H31N5O2 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2383


InChI=1/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2
C21H31N5O2385.50311151557221318
78316458
InChI=1/C21H31N5O2/c1-13(2)26-9-7-15(8-10-26)22-20-16-11-18(27-3)19(28-4)12-17(16)24-21(25-20)23-14-5-6-14/h11-15H,5-10H2,1-4H3,(H2,22,23,24,25)
C21H31N5O2385.5031232800
72380069

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H31N5O2/c1-3-17(26-7-11-28-12-8-26)4-2-16(1)25-21-19-18(15-5-9-27-10-6-15)13-22-20(19)23-14-24-21/h13-17H,1-12H2,(H2,22,23,24,25)/t16-,17-
C21H31N5O2385.5031181800
21636291
InChI=1/C21H31N5O2/c1-3-4-6-18-7-9-19(10-8-18)26-17(2)20(23-24-26)21(27)22-11-5-12-25-13-15-28-16-14-25/h7-10H,3-6,11-16H2,1-2H3,(H,22,27)
C21H31N5O2385.5031171000
11753663

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-2-7-20-19(6-1)22-21-25(15-18-5-3-12-28-18)16-24(17-26(20)21)9-4-8-23-10-13-27-14-11-23/h1-2,6-7,18H,3-5,8-17H2
C21H31N5O2385.5031161100
23479215
InChI=1/C21H31N5O2/c1-6-17-16(2)22-21-25(18-10-7-8-11-19(18)28-5)14-24(13-9-12-23(3)4)15-26(21)20(17)27/h7-8,10-11H,6,9,12-15H2,1-5H3
C21H31N5O2385.503113800
1232174
InChI=1/C21H31N5O2/c1-27-18-9-8-17(16-19(18)28-2)10-15-26-20(22-23-24-26)21(11-4-5-12-21)25-13-6-3-7-14-25/h8-9,16H,3-7,10-15H2,1-2H3
C21H31N5O2385.503113900
6022802

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H31N5O2/c1-14(2)9-10-22-19(27)17(13-15(3)4)24-21(28)26-12-11-25-18-8-6-5-7-16(18)23-20(25)26/h5-8,14-15,17H,9-13H2,1-4H3,(H,22,27)(H,24,28)/t17-/m0/s1
C21H31N5O2385.5031131000
6374302
InChI=1/C21H31N5O2/c1-15(2)20-17-6-4-5-16(17)18(13-22)21(24-20)26-10-8-25(9-11-26)19(27)14-23-7-12-28-3/h15,23H,4-12,14H2,1-3H3
C21H31N5O2385.5031121000
7564527
InChI=1/C21H31N5O2/c1-15-16(2)26(18-7-5-4-6-8-18)21(19(15)13-22)23-20(28)14-24-9-11-25(12-10-24)17(3)27/h18H,4-12,14H2,1-3H3,(H,23,28)
C21H31N5O2385.503111900
27324019

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-17(20(27)23-12-10-18-7-3-2-4-8-18)24-21(28)26-15-13-25(14-16-26)19-9-5-6-11-22-19/h5-7,9,11,17H,2-4,8,10,12-16H2,1H3,(H,23,27)(H,24,28)
C21H31N5O2385.503111800
22233731

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-15-12-19(24-21(23-15)25(3)4)26-11-5-6-17(14-26)8-10-20(27)22-13-18-9-7-16(2)28-18/h7,9,12,17H,5-6,8,10-11,13-14H2,1-4H3,(H,22,27)
C21H31N5O2385.503111900
21099219
InChI=1/C21H31N5O2/c1-14-11-15(2)23-20(22-14)26-19(12-17(25-26)21(3,4)5)28-13-18(27)24-16-9-7-6-8-10-16/h11-12,16H,6-10,13H2,1-5H3,(H,24,27)
C21H31N5O2385.503110800
22119971

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-6-7-26-15(3)16(20-17(26)9-21(4,5)10-18(20)27)8-19(28)24-14(2)11-25-13-22-12-23-25/h12-14H,6-11H2,1-5H3,(H,24,28)
C21H31N5O2385.503110900
22120069
InChI=1/C21H31N5O2/c27-14-13-24-11-6-17(7-12-24)15-22-16-18-20(21(28)25-8-3-4-9-25)23-19-5-1-2-10-26(18)19/h1-2,5,10,17,22,27H,3-4,6-9,11-16H2
C21H31N5O2385.503110900
22121908

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c27-20-8-7-17(16-26(20)18-5-3-1-2-4-6-18)21(28)25-13-11-24(12-14-25)19-15-22-9-10-23-19/h9-10,15,17-18H,1-8,11-14,16H2
C21H31N5O2385.503110900
22128868

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-15-11-16(2)13-18(12-15)14-25-7-5-19-23-24-21(26(19)9-8-25)17(3)22-20(27)6-10-28-4/h11-13,17H,5-10,14H2,1-4H3,(H,22,27)
C21H31N5O2385.503110900
22134749

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-4-13-28-18-7-6-11-26(15-18)19-9-8-17(14-23-19)21(27)25(5-2)16-20-22-10-12-24(20)3/h8-10,12,14,18H,4-7,11,13,15-16H2,1-3H3
C21H31N5O2385.503110900
22144608

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c1-17(22-20(27)11-16-28-2)21-24-23-19-10-13-25(14-15-26(19)21)12-6-9-18-7-4-3-5-8-18/h3-5,7-8,17H,6,9-16H2,1-2H3,(H,22,27)
C21H31N5O2385.503110900
22148206

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O2/c27-16-17-7-1-3-10-24(17)14-9-22-15-18-20(21(28)25-11-5-6-12-25)23-19-8-2-4-13-26(18)19/h2,4,8,13,17,22,27H,1,3,5-7,9-12,14-16H2
C21H31N5O2385.503110900
12345

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