Neoechinulin
[CAS# 25644-25-1]

Identification

• Name: Neoechinulin
• Synonyms: (6Z)-6-[[2-(1,1-Dimethylprop-2-Enyl)-6-(3-Methylbut-2-Enyl)-1H-Indol-3-Yl]Methylene]Piperazine-2,3,5-Trione; Neoechinulin; Piperazinetrione, ((2-(1,1-Dimethyl-2-Propenyl)-6-(3-Methyl-2-Butenyl)-1H-Indol-3-Yl)Methylene)-, (Z)-
• Molecular Formula: C₂₃H₂₅N₃O₃
• Molecular Weight: 391.47
• CAS Registry Number: 25644-25-1
• SMILES: C1=C2C(=CC(=C1)CC=C(C)C)[NH]C(=C2/C=C/3NC(C(=O)NC3=O)=O)C(C=C)(C)C
• InChI: 1S/C23H25N3O3/c1-6-23(4,5)19-16(12-18-20(27)26-22(29)21(28)25-18)15-10-9-14(8-7-13(2)3)11-17(15)24-19/h6-7,9-12,24H,1,8H2,2-5H3,(H,25,28)(H,26,27,29)/b18-12-
• InChIKey: UMQMXLLNFXQTIE-PDGQHHTCSA-N

Properties

• Density: 1.215g/cm³ (Cal.)