| SpectraBase Spectrum ID |
D17d89hyut4 |
| Name |
1H-Pyrrole-3-propanoic acid, 5-[(3-ethenyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-2-[[5-(methoxycarbonyl)-3-(3-methoxy-3-oxopropyl)-4-methyl-2H-pyrrol-2-ylidene]methyl]-4-methyl-, methyl ester, (Z,Z)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
535.231850408 u |
| Formula |
C29H33N3O7 |
| InChI |
InChI=1S/C29H33N3O7/c1-8-18-17(4)28(35)32-22(18)13-21-15(2)19(9-11-25(33)37-5)23(30-21)14-24-20(10-12-26(34)38-6)16(3)27(31-24)29(36)39-7/h8,13-14,30H,1,9-12H2,2-7H3,(H,32,35)/b22-13-,24-14- |
| InChIKey |
LIMQVCXEHJFLHL-YXDRJAMLSA-N |
| Molecular Weight |
535.597 g/mol |
| SMILES |
C=1(\C(N=C(C1C)C(=O)OC)=C\C=1NC(\C=C\2NC(=O)C(=C2C=C)C)=C(C1CCC(=O)OC)C)CCC(=O)OC |
![1H-Pyrrole-3-propanoic acid, 5-[(3-ethenyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-2-[[5-(methoxycarbonyl)-3-(3-methoxy-3-oxopropyl)-4-methyl-2H-pyrrol-2-ylidene]methyl]-4-methyl-, methyl ester, (Z,Z)-](/api/spectrum/D17d89hyut4/structure.png?h=300&w=458 "1H-Pyrrole-3-propanoic acid, 5-[(3-ethenyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-2-[[5-(methoxycarbonyl)-3-(3-methoxy-3-oxopropyl)-4-methyl-2H-pyrrol-2-ylidene]methyl]-4-methyl-, methyl ester, (Z,Z)-")
