| SpectraBase Spectrum ID |
Ik2F67ZPNe3 |
| Name |
1H-Pyrrole-2-carboxylic acid, 5,5'-[(2,3,5,6-tetramethyl-1,4-phenylene)bis[5,1-pentanediyl[5-(2,2-dicyanoethenyl)-4-methyl-1H-pyrrole-3,2-diyl]methylene]]bis[4-ethyl-3-methyl-, diethyl ester |
| CAS Registry Number |
102393-35-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C60H74N8O4 |
| InChI |
InChI=1S/C60H74N8O4/c1-13-45-41(11)57(59(69)71-15-3)67-53(45)29-55-49(39(9)51(65-55)27-43(31-61)32-62)25-21-17-19-23-47-35(5)37(7)48(38(8)36(47)6)24-20-18-22-26-50-40(10)52(28-44(33-63)34-64)66-56(50)30-54-46(14-2)42(12)58(68-54)60(70)72-16-4/h27-28,65-68H,13-26,29-30H2,1-12H3 |
| InChIKey |
WPNYVIIXBKEHEO-UHFFFAOYSA-N |
| Molecular Weight |
971.304 g/mol |
| SMILES |
[nH]1c(c(c(c1Cc1c(CCCCCc2c(c(c(CCCCCc3c(Cc4c(c(c([nH]4)C(=O)OCC)C)CC)[nH]c(c3C)C=C(C#N)C#N)c(c2C)C)C)C)c(C)c([nH]1)C=C(C#N)C#N)CC)C)C(=O)OCC |
| SPLASH |
splash10-0002-0000000900-363e5616cc96abfd2619 |
| Source of Spectrum |
I-66-2070-31 |
| Synonyms |
1,4-bis{5-[2-(5-ethoxycarbonyl-3-ethyl-4-methylpyrrol-2-yl)methyl]-5-(2,2-dicyanovinyl)-4-methylpyrrol-3-yl]pentyl}-2,3,5,6-tetramethylbenzene
Ethyl 5-{[5-(2,2-dicyanoeth-1-en-1-yl)-3-[5-(4-{5-[5-(2,2-dicyanoeth-1-en-1-yl)-2-{[5-(ethoxycarbonyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl}-4-methyl-1H-pyrrol-3-yl]pentyl}-2,3,5,6-tetramethylphenyl)pentyl]-4-methyl-1H-pyrrol-2-yl]methyl}-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate |
| Wiley ID |
1418306 |
![1,4-BIS-[5-[2-[(5-CARBETHOXY-3-ETHYL-2-METHYLPYRROL-2-YL)-METHYL]-5-(2,2-DICYANOETHENYL)-4-METHYL-PYRROL-3-YL]-PENTYL]-2,3,5,6-TETRAMETHYLBENZENE](/api/spectrum/Ik2F67ZPNe3/structure.png?h=300&w=458 "1,4-BIS-[5-[2-[(5-CARBETHOXY-3-ETHYL-2-METHYLPYRROL-2-YL)-METHYL]-5-(2,2-DICYANOETHENYL)-4-METHYL-PYRROL-3-YL]-PENTYL]-2,3,5,6-TETRAMETHYLBENZENE")
