| SpectraBase Spectrum ID |
K3BlQEciUef |
| Name |
2,6-Bis(4-ethynyltoluene)-4-nitro-N-(butyryl-4-{7-oxy-4-methylcomarin ester})aniline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C38H28N2O7 |
| InChI |
InChI=1S/C38H28N2O7/c1-24-4-8-27(9-5-24)12-14-29-21-31(40(44)45)22-30(15-13-28-10-6-25(2)7-11-28)38(29)39-35(41)18-19-36(42)46-32-16-17-33-26(3)20-37(43)47-34(33)23-32/h4-11,16-17,20-23H,18-19H2,1-3H3,(H,39,41) |
| InChIKey |
ICPMRCYJJJRAAE-UHFFFAOYSA-N |
| Molecular Weight |
624.649 g/mol |
| SMILES |
N(c1c(C#Cc2ccc(cc2)C)cc(N(=O)=O)cc1C#Cc1ccc(cc1)C)C(=O)CCC(Oc1cc2OC(=O)C=C(c2cc1)C)=O |
| SPLASH |
splash10-0gc0-0000090000-cc3455b38649c2c47024 |
| Source of Spectrum |
J-67-6709-3 |
| Synonyms |
4-[2,6-bis[2-(4-methylphenyl)ethynyl]-4-nitroanilino]-4-oxobutanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester
(4-methyl-2-oxochromen-7-yl) 4-[2,6-bis[2-(4-methylphenyl)ethynyl]-4-nitroanilino]-4-oxobutanoate
(4-methyl-2-oxo-chromen-7-yl) 4-[4-nitro-2,6-bis[2-(p-tolyl)ethynyl]anilino]-4-oxo-butanoate
(4-methyl-2-oxidanylidene-chromen-7-yl) 4-[[2,6-bis[2-(4-methylphenyl)ethynyl]-4-nitro-phenyl]amino]-4-oxidanylidene-butanoate |
| Wiley ID |
1570908 |
