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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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Single/Multi-component
Isotopically Labeled
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Found 36 results

Search term: C22H28N2O3 (Found by synonym)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2107231

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O3/c1-13-18(21(26)27-6)19(14-7-9-15(10-8-14)24(4)5)20-16(23-13)11-22(2,3)12-17(20)25/h7-10,19,23H,11-12H2,1-6H3
C22H28N2O3368.46932243200
4468262

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H28N2O3/c1-6-13(2)27-22(26)21-14(3)20-18(23-21)11-16(12-19(20)25)15-7-9-17(10-8-15)24(4)5/h7-10,13,16,23H,6,11-12H2,1-5H3
C22H28N2O3368.46932232600
12007205

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O3/c1-23(2)19-10-6-17(7-11-19)15-24(16-21-5-4-14-27-21)22(25)18-8-12-20(26-3)13-9-18/h6-13,21H,4-5,14-16H2,1-3H3
C22H28N2O3368.4693222800
4125038
InChI=1/C22H28N2O3/c1-4-14-23-21(25)17-9-5-7-11-19(17)24-22(26)18-10-6-8-12-20(18)27-15-13-16(2)3/h5-12,16H,4,13-15H2,1-3H3,(H,23,25)(H,24,26)
C22H28N2O3368.46932212700
4140180
InChI=1/C22H28N2O3/c1-2-3-4-5-9-16-21(25)23-24-22(26)17-27-20-15-11-10-14-19(20)18-12-7-6-8-13-18/h6-8,10-15H,2-5,9,16-17H2,1H3,(H,23,25)(H,24,26)
C22H28N2O3368.46932202700
4408556
InChI=1/C22H28N2O3/c1-15-9-11-23(12-10-15)14-21(25)20-13-16(2)24(17(20)3)19-7-5-18(6-8-19)22(26)27-4/h5-8,13,15H,9-12,14H2,1-4H3
C22H28N2O3368.46932192200
1619155
InChI=1/C22H28N2O3/c1-3-5-7-21(25)23-17-9-13-19(14-10-17)27-20-15-11-18(12-16-20)24-22(26)8-6-4-2/h9-16H,3-8H2,1-2H3,(H,23,25)(H,24,26)
C22H28N2O3368.4693192100
2213648

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O3/c1-16-13-17(2)15-19(14-16)27-18(3)22(25)24-11-9-23(10-12-24)20-7-5-6-8-21(20)26-4/h5-8,13-15,18H,9-12H2,1-4H3
C22H28N2O3368.46932182400
4962955

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H28N2O3/c1-15-7-8-19(16(2)13-15)24-21(25)14-18(22(24)26)17-5-3-4-6-20(17)23-9-11-27-12-10-23/h6-8,13,17-18H,3-5,9-12,14H2,1-2H3
C22H28N2O3368.4693182200
2212536

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O3/c1-16-5-8-21(15-17(16)2)27-18(3)22(25)24-13-11-23(12-14-24)19-6-9-20(26-4)10-7-19/h5-10,15,18H,11-14H2,1-4H3
C22H28N2O3368.46932172400
578648

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H28N2O3/c1-15-9-10-16-13-17(21(25)23-19(16)12-15)14-24(18-6-3-2-4-7-18)22(26)20-8-5-11-27-20/h9-10,12-13,18,20H,2-8,11,14H2,1H3,(H,23,25)
C22H28N2O3368.4693172000
1280842
InChI=1/C22H28N2O3/c1-17-5-3-6-21(18(17)2)27-14-4-7-22(25)23-19-8-10-20(11-9-19)24-12-15-26-16-13-24/h3,5-6,8-11H,4,7,12-16H2,1-2H3,(H,23,25)
C22H28N2O3368.4693172000
11755790

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H28N2O3/c1-27-17-11-9-16(10-12-17)24-21(25)15-19(22(24)26)18-7-3-4-8-20(18)23-13-5-2-6-14-23/h8-12,18-19H,2-7,13-15H2,1H3
C22H28N2O3368.4693162000
4152974
InChI=1/C22H28N2O3/c1-4-24(14-17-8-6-5-7-9-17)22(25)16-23-11-10-18-12-20(26-2)21(27-3)13-19(18)15-23/h5-9,12-13H,4,10-11,14-16H2,1-3H3
C22H28N2O3368.46932151700
1309166

Double-bond stereo
InChI=1/C22H28N2O3/c1-5-12-26-19-9-7-18(8-10-19)14-23-24-22(25)15-27-21-13-17(4)6-11-20(21)16(2)3/h6-11,13-14,16H,5,12,15H2,1-4H3,(H,24,25)
C22H28N2O3368.4693151700
1466683
InChI=1/C22H28N2O3/c1-3-5-7-17-8-10-18(11-9-17)21(25)23-24-22(26)19-12-14-20(15-13-19)27-16-6-4-2/h8-15H,3-7,16H2,1-2H3,(H,23,25)(H,24,26)
C22H28N2O3368.4693151700
263807

Double-bond stereo
InChI=1/C22H28N2O3/c1-3-5-6-7-8-9-22(25)27-21-16-12-19(13-17-21)24-23-18-10-14-20(15-11-18)26-4-2/h10-17H,3-9H2,1-2H3/b24-23+
C22H28N2O3368.4693151700
12095109

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H28N2O3/c1-20(2)21(3)9-10-22(20,18(26)17(21)25)19(27)24-13-11-23(12-14-24)15-16-7-5-4-6-8-16/h4-8H,9-15H2,1-3H3
C22H28N2O3368.4693151900
1522052

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H28N2O3/c1-16(2)14-20(21(25)27-3)24-22(26)23-15-19(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,19-20H,14-15H2,1-3H3,(H2,23,24,26)/t20-/m0/s1
C22H28N2O3368.4693111200
949819

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H28N2O3/c1-15(25)23-12-13-24-19-11-10-17(16-6-3-2-4-7-16)14-18(19)21(26)9-5-8-20(23)22(24)27/h10-11,14,16,20H,2-9,12-13H2,1H3/t20-/m0/s1
C22H28N2O3368.4693101100
12

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