10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran

C375H250O9 — CID 161128274

IUPAC10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(C(c3cccc(-c4cc5c6ccccc6oc5c5ccccc45)c3)c3cccc(-c4cc5c6ccccc6oc5c5ccccc45)c3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(C(c3cccc(-c4cc5ccccc5c5c4oc4ccc6ccccc6c45)c3)c3ccc4c(c3)C(C)(C)c3cc(-c5ccccc5)ccc3-4)cc21.c1ccc(-c2ccc(-c3ccc(C(c4cccc(-c5cc6ccccc6c6c5oc5ccc7ccccc7c56)c4)c4cccc5ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(C(c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)cc3)cc2)cc1.c1ccc(-c2cccc(-c3ccc(C(c4ccc(-c5cccc(-c6ccccc6)c5)cc4)c4cccc(-c5cc6c7ccccc7oc6c6ccccc56)c4)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(C(c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)cc3)c2)cc1
InChIInChI=1S/C69H50O.C66H44O2.2C63H40O2.C59H40O.C55H36O/c1-68(2)59-38-45(42-16-7-5-8-17-42)26-31-54(59)56-33-28-50(40-61(56)68)64(51-29-34-57-55-32-27-46(43-18-9-6-10-19-43)39-60(55)69(3,4)62(57)41-51)49-23-15-22-47(36-49)58-37-48-21-12-14-25-53(48)66-65-52-24-13-11-20-44(52)30-35-63(65)70-67(58)66;1-66(2)59-36-41(40-16-4-3-5-17-40)30-32-49(59)50-33-31-46(37-60(50)66)63(44-20-14-18-42(34-44)55-38-57-51-24-10-12-28-61(51)67-64(57)53-26-8-6-22-47(53)55)45-21-15-19-43(35-45)56-39-58-52-25-11-13-29-62(52)68-65(58)54-27-9-7-23-48(54)56;1-2-11-40(12-3-1)45-15-8-16-46(35-45)41-23-25-44(26-24-41)61(51-19-9-17-47(36-51)49-29-31-57-55(38-49)62-53-21-6-4-13-42(53)27-33-59(62)64-57)52-20-10-18-48(37-52)50-30-32-58-56(39-50)63-54-22-7-5-14-43(54)28-34-60(63)65-58;1-2-10-40(11-3-1)41-20-22-42(23-21-41)43-24-26-46(27-25-43)61(51-16-8-14-47(36-51)49-30-32-57-55(38-49)62-53-18-6-4-12-44(53)28-34-59(62)64-57)52-17-9-15-48(37-52)50-31-33-58-56(39-50)63-54-19-7-5-13-45(54)29-35-60(63)65-58;1-3-14-40(15-4-1)46-18-11-20-48(36-46)42-28-32-44(33-29-42)58(45-34-30-43(31-35-45)49-21-12-19-47(37-49)41-16-5-2-6-17-41)51-23-13-22-50(38-51)55-39-56-53-25-9-10-27-57(53)60-59(56)54-26-8-7-24-52(54)55;1-2-12-36(13-3-1)37-24-26-38(27-25-37)39-28-30-42(31-29-39)52(49-23-11-17-40-14-4-7-20-46(40)49)45-19-10-18-43(34-45)50-35-44-16-6-9-22-48(44)54-53-47-21-8-5-15-41(47)32-33-51(53)56-55(50)54/h5-41,64H,1-4H3;3-39,63H,1-2H3;2*1-39,61H;1-39,58H;1-35,52H
InChIKeyULVMQKZUINWNJB-UHFFFAOYSA-N
MW4900.12 g/mol
LogP103.73
Rot. Bonds40

About 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran

10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran (PubChem CID 161128274) has the molecular formula C375H250O9 and a molecular weight of 4900.12 g/mol. Its IUPAC name is 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran
PubChem CID161128274
Molecular FormulaC375H250O9
Molecular Weight4900.12 g/mol
Exact Mass4895.91
IUPAC Name10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(C(c3cccc(-c4cc5c6ccccc6oc5c5ccccc45)c3)c3cccc(-c4cc5c6ccccc6oc5c5ccccc45)c3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(C(c3cccc(-c4cc5ccccc5c5c4oc4ccc6ccccc6c45)c3)c3ccc4c(c3)C(C)(C)c3cc(-c5ccccc5)ccc3-4)cc21.c1ccc(-c2ccc(-c3ccc(C(c4cccc(-c5cc6ccccc6c6c5oc5ccc7ccccc7c56)c4)c4cccc5ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(C(c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)cc3)cc2)cc1.c1ccc(-c2cccc(-c3ccc(C(c4ccc(-c5cccc(-c6ccccc6)c5)cc4)c4cccc(-c5cc6c7ccccc7oc6c6ccccc56)c4)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(C(c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)cc3)c2)cc1
InChIInChI=1S/C69H50O.C66H44O2.2C63H40O2.C59H40O.C55H36O/c1-68(2)59-38-45(42-16-7-5-8-17-42)26-31-54(59)56-33-28-50(40-61(56)68)64(51-29-34-57-55-32-27-46(43-18-9-6-10-19-43)39-60(55)69(3,4)62(57)41-51)49-23-15-22-47(36-49)58-37-48-21-12-14-25-53(48)66-65-52-24-13-11-20-44(52)30-35-63(65)70-67(58)66;1-66(2)59-36-41(40-16-4-3-5-17-40)30-32-49(59)50-33-31-46(37-60(50)66)63(44-20-14-18-42(34-44)55-38-57-51-24-10-12-28-61(51)67-64(57)53-26-8-6-22-47(53)55)45-21-15-19-43(35-45)56-39-58-52-25-11-13-29-62(52)68-65(58)54-27-9-7-23-48(54)56;1-2-11-40(12-3-1)45-15-8-16-46(35-45)41-23-25-44(26-24-41)61(51-19-9-17-47(36-51)49-29-31-57-55(38-49)62-53-21-6-4-13-42(53)27-33-59(62)64-57)52-20-10-18-48(37-52)50-30-32-58-56(39-50)63-54-22-7-5-14-43(54)28-34-60(63)65-58;1-2-10-40(11-3-1)41-20-22-42(23-21-41)43-24-26-46(27-25-43)61(51-16-8-14-47(36-51)49-30-32-57-55(38-49)62-53-18-6-4-12-44(53)28-34-59(62)64-57)52-17-9-15-48(37-52)50-31-33-58-56(39-50)63-54-19-7-5-13-45(54)29-35-60(63)65-58;1-3-14-40(15-4-1)46-18-11-20-48(36-46)42-28-32-44(33-29-42)58(45-34-30-43(31-35-45)49-21-12-19-47(37-49)41-16-5-2-6-17-41)51-23-13-22-50(38-51)55-39-56-53-25-9-10-27-57(53)60-59(56)54-26-8-7-24-52(54)55;1-2-12-36(13-3-1)37-24-26-38(27-25-37)39-28-30-42(31-29-39)52(49-23-11-17-40-14-4-7-20-46(40)49)45-19-10-18-43(34-45)50-35-44-16-6-9-22-48(44)54-53-47-21-8-5-15-41(47)32-33-51(53)56-55(50)54/h5-41,64H,1-4H3;3-39,63H,1-2H3;2*1-39,61H;1-39,58H;1-35,52H
InChIKeyULVMQKZUINWNJB-UHFFFAOYSA-N
XLogP103.73
TPSA118.26 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds40
Heavy Atoms384
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004900.12
LogP ≤ 5103.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran with MolForge

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Related Compounds

4-[3-[4-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]phenyl]dibenzofuran;2-[3-[bis[4-(3-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran;2-[3-[naphthalen-1-yl-[4-(3-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran;2-[3-[[4-(3-phenylphenyl)phenyl]-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 159495965
3-[4-[(4-dibenzofuran-3-ylphenyl)-(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]dibenzofuran;3-[4-[(4-dibenzofuran-3-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran;3-[4-[(4-dibenzofuran-3-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran;9-[4-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(4-naphtho[2,1-b][1]benzofuran-9-ylphenyl)methyl]phenyl]naphtho[2,1-b][1]benzofuran;9-[4-[(4-naphtho[1,2-b][1]benzofuran-9-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;9-[4-[(4-naphtho[2,1-b][1]benzofuran-9-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran
CID 157305645
10-[4-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)methyl]phenyl]naphtho[2,1-b][1]benzofuran
CID 59136925
2-[3-[4-[bis(9,9-dimethyl-7-naphthalen-2-ylfluoren-2-yl)methyl]phenyl]phenyl]dibenzofuran;2-[3-[bis[4-[3-(4-methylphenyl)phenyl]phenyl]methyl]phenyl]dibenzofuran;2-[3-[bis[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran;2-[3-[4-[naphthalen-1-yl-[4-(3-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 159462460
2-[3-[(9,9-dimethyl-7-naphthalen-2-ylfluoren-2-yl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59136691
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-naphtho[1,2-b][1]benzofuran-5-yl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)phenyl]-7-phenylfluoren-2-amine;9,9-dimethyl-N-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 160561791
N,N-bis(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)-4-(4-phenylphenyl)aniline;N-(9,9-dimethyl-7-phenylfluoren-2-yl)-9,9-dimethyl-N-[4-(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)phenyl]-7-phenylfluoren-2-amine;methane;N-[4-(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 159537336
2-[9,9-dimethyl-7-[(4-naphthalen-1-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]fluoren-2-yl]dibenzofuran
CID 59136781
10-[3-[bis[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 59136719
2-[7-[bis[4-(4-phenylphenyl)phenyl]methyl]-9,9-dimethylfluoren-2-yl]dibenzofuran
CID 59136953
4-[3-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 59136983
4-[4-[3-[bis(9,9-dimethyl-7-naphthalen-2-ylfluoren-2-yl)methyl]phenyl]phenyl]dibenzofuran
CID 59136907

Frequently Asked Questions

What is the IUPAC name of 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran?
The IUPAC name of 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran (CID 161128274) is 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran?
The canonical SMILES for 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran is CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(C(c3cccc(-c4cc5c6ccccc6oc5c5ccccc45)c3)c3cccc(-c4cc5c6ccccc6oc5c5ccccc45)c3)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(C(c3cccc(-c4cc5ccccc5c5c4oc4ccc6ccccc6c45)c3)c3ccc4c(c3)C(C)(C)c3cc(-c5ccccc5)ccc3-4)cc21.c1ccc(-c2ccc(-c3ccc(C(c4cccc(-c5cc6ccccc6c6c5oc5ccc7ccccc7c56)c4)c4cccc5ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(C(c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)cc3)cc2)cc1.c1ccc(-c2cccc(-c3ccc(C(c4ccc(-c5cccc(-c6ccccc6)c5)cc4)c4cccc(-c5cc6c7ccccc7oc6c6ccccc56)c4)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(C(c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)c4cccc(-c5ccc6oc7ccc8ccccc8c7c6c5)c4)cc3)c2)cc1.
What is the InChIKey of 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran?
The InChIKey is ULVMQKZUINWNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H50O.C66H44O2.2C63H40O2.C59H40O.C55H36O/c1-68(2)59-38-45(42-16-7-5-8-17-42)26-31-54(59)56-33-28-50(40-61(56)68)64(51-29-34-57-55-32-27-46(43-18-9-6-10-19-43)39-60(55)69(3,4)62(57)41-51)49-23-15-22-47(36-49)58-37-48-21-12-14-25-53(48)66-65-52-24-13-11-20-44(52)30-35-63(65)70-67(58)66;1-66(2)59-36-41(40-16-4-3-5-17-40)30-32-49(59)50-33-31-46(37-60(50)66)63(44-20-14-18-42(34-44)55-38-57-51-24-10-12-28-61(51)67-64(57)53-26-8-6-22-47(53)55)45-21-15-19-43(35-45)56-39-58-52-25-11-13-29-62(52)68-65(58)54-27-9-7-23-48(54)56;1-2-11-40(12-3-1)45-15-8-16-46(35-45)41-23-25-44(26-24-41)61(51-19-9-17-47(36-51)49-29-31-57-55(38-49)62-53-21-6-4-13-42(53)27-33-59(62)64-57)52-20-10-18-48(37-52)50-30-32-58-56(39-50)63-54-22-7-5-14-43(54)28-34-60(63)65-58;1-2-10-40(11-3-1)41-20-22-42(23-21-41)43-24-26-46(27-25-43)61(51-16-8-14-47(36-51)49-30-32-57-55(38-49)62-53-18-6-4-12-44(53)28-34-59(62)64-57)52-17-9-15-48(37-52)50-31-33-58-56(39-50)63-54-19-7-5-13-45(54)29-35-60(63)65-58;1-3-14-40(15-4-1)46-18-11-20-48(36-46)42-28-32-44(33-29-42)58(45-34-30-43(31-35-45)49-21-12-19-47(37-49)41-16-5-2-6-17-41)51-23-13-22-50(38-51)55-39-56-53-25-9-10-27-57(53)60-59(56)54-26-8-7-24-52(54)55;1-2-12-36(13-3-1)37-24-26-38(27-25-37)39-28-30-42(31-29-39)52(49-23-11-17-40-14-4-7-20-46(40)49)45-19-10-18-43(34-45)50-35-44-16-6-9-22-48(44)54-53-47-21-8-5-15-41(47)32-33-51(53)56-55(50)54/h5-41,64H,1-4H3;3-39,63H,1-2H3;2*1-39,61H;1-39,58H;1-35,52H.
What are the key properties of 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran?
10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran has a molecular weight of 4900.12 g/mol, XLogP of 103.73, 40 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-[bis(9,9-dimethyl-7-phenylfluoren-2-yl)methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;5-[3-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[1,2-b][1]benzofuran;5-[3-[(9,9-dimethyl-7-phenylfluoren-2-yl)-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)methyl]phenyl]naphtho[1,2-b][1]benzofuran;10-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(3-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran;10-[3-[(3-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]naphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 161128274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).