About 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile
3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile (PubChem CID 161359201) has the molecular formula C312H164N32O7
and a molecular weight of 4472.96 g/mol. Its IUPAC name is 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile.
Frequently Asked Questions
What is the IUPAC name of 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile?
The IUPAC name of 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile (CID 161359201) is 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile.
What is the SMILES notation for 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile?
The canonical SMILES for 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile is N#Cc1cc(-c2cc(C#N)c(-n3c4ccccc4c4ccccc43)cc2C#N)c(C#N)c(-n2c3ccccc3c3cc4oc5ccccc5c4cc32)c1.N#Cc1cc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1cc(-c2cccc(-n3c4ccccc4c4ccc5c6ccccc6oc5c43)c2)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1cc(-c2cccc(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c2)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1cc(-n2c3ccccc3c3ccccc32)c(C#N)c(C#N)c1-c1cccc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)c1.N#Cc1cc(-n2c3ccccc3c3ccccc32)c(C#N)cc1-c1ccc(C#N)c(-n2c3ccccc3c3c4c(ccc32)oc2ccccc24)c1C#N.[C-]#[N+]c1cc(-c2ccc(C#N)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c2C#N)cc(C#N)c1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile?
The InChIKey is VOYHOJIEPPJFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/3C46H22N6O.C45H23N5O.3C43H25N3O/c1-50-37-23-28(22-29(25-48)45(37)51-38-14-6-2-10-31(38)32-11-3-7-15-39(32)51)30-19-18-27(24-47)44(36(30)26-49)52-40-16-8-4-13-35(40)43-41(52)21-20-34-33-12-5-9-17-42(33)53-46(34)43;47-23-27-17-35(34-19-29(25-49)42(20-28(34)24-48)51-39-13-5-1-9-30(39)31-10-2-6-14-40(31)51)38(26-50)43(18-27)52-41-15-7-3-11-32(41)36-22-46-37(21-44(36)52)33-12-4-8-16-45(33)53-46;47-23-27-17-18-30(35-21-29(25-49)41(22-28(35)24-48)51-37-13-5-1-9-31(37)32-10-2-6-14-38(32)51)36(26-50)46(27)52-39-15-7-3-11-33(39)44-40(52)19-20-43-45(44)34-12-4-8-16-42(34)53-43;46-24-28-21-41(50-39-17-6-1-12-30(39)31-13-2-7-18-40(31)50)36(25-47)37(26-48)45(28)27-10-9-11-29(20-27)49-38-16-5-3-14-32(38)34-22-35-33-15-4-8-19-43(33)51-44(35)23-42(34)49;44-26-27-20-29(23-31(21-27)46-38-16-5-1-12-32(38)33-13-2-6-17-39(33)46)28-10-9-11-30(22-28)45-40-18-7-3-14-34(40)36-24-37-35-15-4-8-19-42(35)47-43(37)25-41(36)45;44-26-27-22-29(25-31(23-27)45-37-16-5-1-12-32(37)33-13-2-6-17-38(33)45)28-10-9-11-30(24-28)46-39-18-7-3-14-34(39)35-20-21-41-42(43(35)46)36-15-4-8-19-40(36)47-41;44-26-27-22-29(25-31(23-27)45-38-16-5-1-12-32(38)33-13-2-6-17-39(33)45)28-10-9-11-30(24-28)46-40-18-7-3-14-34(40)36-20-21-37-35-15-4-8-19-41(35)47-43(37)42(36)46/h2-23H;2*1-22H;1-23H;3*1-25H.
What are the key properties of 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile?
3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile has a molecular weight of 4472.96 g/mol, XLogP of 78.50, 21 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-b]carbazol-11-yl)-6-(4-carbazol-9-yl-2,5-dicyanophenyl)benzene-1,4-dicarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-6-carbazol-9-ylbenzene-1,2,4-tricarbonitrile;3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-5-carbazol-9-ylbenzonitrile;2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(4-carbazol-9-yl-3-cyano-5-isocyanophenyl)benzene-1,3-dicarbonitrile;4-(4-carbazol-9-yl-2,5-dicyanophenyl)-2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzene-1,3-dicarbonitrile is sourced from PubChem (CID 161359201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).