About 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene
4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene (PubChem CID 157074850) has the molecular formula C160H108N20O4+8
and a molecular weight of 2374.76 g/mol. Its IUPAC name is 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene.
Frequently Asked Questions
What is the IUPAC name of 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene?
The IUPAC name of 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene (CID 157074850) is 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene.
What is the SMILES notation for 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene?
The canonical SMILES for 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene is Cc1cc(-c2ccccc2)cc(C)c1-c1cc2n(c1)C13c4c(ccc5c6ccccc6n(c45)-c4cccc[n+]41)Oc1cccc-2[n+]13.Cc1cc(-c2ccccc2)cc(C)c1-c1cc2n(n1)C13c4c(ccc5c6ccccc6n(c45)-c4cccc[n+]41)Oc1cccc-2[n+]13.Cc1cc(-c2ccccc2)cc(C)c1-c1cn2c(n1)-c1cccc3[n+]1C21c2c(ccc4c5ccccc5n(c24)-c2cccc[n+]21)O3.Cc1cc(-c2ccccc2)cc(C)c1-c1nc2n(n1)C13c4c(ccc5c6ccccc6n(c45)-c4cccc[n+]41)Oc1cccc-2[n+]13.
What is the InChIKey of 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene?
The InChIKey is CRQSUGKTMDPPFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H28N4O.2C40H27N5O.C39H26N6O/c1-25-21-28(27-11-4-3-5-12-27)22-26(2)38(25)29-23-34-33-15-10-17-37-45(33)41(43(34)24-29)39-35(46-37)19-18-31-30-13-6-7-14-32(30)44(40(31)39)36-16-8-9-20-42(36)41;1-24-21-27(26-11-4-3-5-12-26)22-25(2)37(24)30-23-33-32-15-10-17-36-44(32)40(45(33)41-30)38-34(46-36)19-18-29-28-13-6-7-14-31(28)43(39(29)38)35-16-8-9-20-42(35)40;1-24-21-27(26-11-4-3-5-12-26)22-25(2)36(24)30-23-43-39(41-30)32-15-10-17-35-45(32)40(43)37-33(46-35)19-18-29-28-13-6-7-14-31(28)44(38(29)37)34-16-8-9-20-42(34)40;1-23-21-26(25-11-4-3-5-12-25)22-24(2)34(23)37-40-38-30-15-10-17-33-44(30)39(45(38)41-37)35-31(46-33)19-18-28-27-13-6-7-14-29(27)43(36(28)35)32-16-8-9-20-42(32)39/h3-24H,1-2H3;2*3-23H,1-2H3;3-22H,1-2H3/q4*+2.
What are the key properties of 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene?
4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene has a molecular weight of 2374.76 g/mol, XLogP of 30.64, 8 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,23-diaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,5,23-tetraza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,3,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene;4-(2,6-dimethyl-4-phenylphenyl)-12-oxa-2,5,23-triaza-29,32-diazonianonacyclo[14.13.2.11,7.02,6.013,30.017,22.023,31.024,29.011,32]dotriaconta-3,5,7(32),8,10,13(30),14,16(31),17,19,21,24,26,28-tetradecaene is sourced from PubChem (CID 157074850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).