| SpectraBase Spectrum ID |
CAxR3ODwavd |
| Name |
ethyl 6-amino-4-(4-(4-benzylpiperazin-1-yl)phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H30N4O3 |
| InChI |
InChI=1S/C27H30N4O3/c1-3-33-27(32)24-19(2)34-26(29)23(17-28)25(24)21-9-11-22(12-10-21)31-15-13-30(14-16-31)18-20-7-5-4-6-8-20/h4-12,25H,3,13-16,18,29H2,1-2H3 |
| InChIKey |
OVRSMPHXPACLTG-UHFFFAOYSA-N |
| Instrument Name |
HP 5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002_1097-0231(20001015)14_19_1783 |
| Molecular Weight |
458.562 g/mol |
| SMILES |
NC=1OC(=C(C(C1C#N)c1ccc(N2CCN(CC2)Cc2ccccc2)cc1)C(=O)OCC)C |
| SPLASH |
splash10-0006-9006200000-a801f828bf620c2279b5 |
| Source of Spectrum |
RCM-14-1784-7 |
| Wiley ID |
1839128 |
