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 103 results

Search term: C21H39NO4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
138915
InChI=1/C21H39NO4/c1-20(2)15-17(16-21(3,4)22(20)5)26-19(24)14-12-10-8-7-9-11-13-18(23)25-6/h17H,7-16H2,1-6H3
C21H39NO4369.5387403600
29341560

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9-/t19-/m0/s1
C21H39NO4369.5387212100
29367297

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(23)26-21(24)19-16-15-18-22(19)25/h19,25H,2-18H2,1H3
C21H39NO4369.5387181600
18775247

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(24)22-17-18(23)16-19(22)21(25)26/h18-19,23H,2-17H2,1H3,(H,25,26)/t18-,19+/m1/s1
C21H39NO4369.5387161800
34999521

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h12-13,19H,5-11,14-18H2,1-4H3/b13-12-/t19-/m1/s1
C21H39NO4369.5387131700
17216151

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h12-13,19H,5-11,14-18H2,1-4H3/b13-12-
C21H39NO4369.5387101100
3147797

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(24)22-17-18(23)16-19(22)21(25)26/h18-19,23H,2-17H2,1H3,(H,25,26)
C21H39NO4369.538710700
9535615
InChI=1/C21H39NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19(23)21(25)22-18-15-17-20(24)26-2/h3-18H2,1-2H3,(H,22,25)
C21H39NO4369.53879700
31047229

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h12-13,19H,5-11,14-18H2,1-4H3/b13-12+/t19-/m1/s1
C21H39NO4369.53878600
28590557

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h12-13,19H,5-11,14-18H2,1-4H3/b13-12+
C21H39NO4369.53878900
58909331

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H39NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18(23)20(24)22-19(17(2)3)21(25)26/h17,19H,4-16H2,1-3H3,(H,22,24)(H,25,26)/t19-/m0/s1
C21H39NO4369.53877700
21466990

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9-
C21H39NO4369.53875400
30776711

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(22(2,3)4)17-18-20(23)24/h15-16,19H,5-14,17-18H2,1-4H3/b16-15+/t19-/m0/s1
C21H39NO4369.53875400
21403179

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h15-16,19H,5-14,17-18H2,1-4H3/b16-15+
C21H39NO4369.53874400
4585778

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9+
C21H39NO4369.53874300
8842160

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-19(24)21(22,17-23)20(25)26-18/h14-15,18-19,23-24H,2-13,16-17,22H2,1H3/b15-14+/t18-,19-,21+/m1/s1
C21H39NO4369.53874300
8936949

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-19(24)21(22,17-23)20(25)26-18/h14-15,18-19,23-24H,2-13,16-17,22H2,1H3/b15-14+/t18-,19+,21+/m1/s1
C21H39NO4369.53874300
34448667

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h15-16,19H,5-14,17-18H2,1-4H3
C21H39NO4369.53873300
34999520

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(17-20(23)24)18-22(2,3)4/h8-9,19H,5-7,10-18H2,1-4H3/b9-8-/t19-/m1/s1
C21H39NO4369.53873400
52563567

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-18(23)20(21(25)26)19(24)17-22(2,3)4/h12-13,19-20,24H,5-11,14-17H2,1-4H3/b13-12-
C21H39NO4369.53873500
12345

Advertisement