4-[4-[2-[[3-(2-Aminoethyl)-1H-Indol-5-Yl]Oxy]Acetyl]-1-Piperazinyl]-Benzonitrile
[CAS# 170912-52-4]

Identification

• Name: 4-[4-[2-[[3-(2-Aminoethyl)-1H-Indol-5-Yl]Oxy]Acetyl]-1-Piperazinyl]-Benzonitrile
• Synonyms: 4-[4-[2-[[3-(2-Aminoethyl)-1H-Indol-5-Yl]Oxy]-1-Oxoethyl]-1-Piperazinyl]Benzonitrile; 4-[4-[2-[[3-(2-Aminoethyl)-1H-Indol-5-Yl]Oxy]Ethanoyl]Piperazin-1-Yl]Benzonitrile; Donitriptan
• Molecular Formula: C₂₃H₂₅N₅O₂
• Molecular Weight: 403.48
• CAS Registry Number: 170912-52-4
• SMILES: C1=C4C(=CC=C1OCC(=O)N3CCN(C2=CC=C(C=C2)C#N)CC3)[NH]C=C4CCN
• InChI: 1S/C23H25N5O2/c24-8-7-18-15-26-22-6-5-20(13-21(18)22)30-16-23(29)28-11-9-27(10-12-28)19-3-1-17(14-25)2-4-19/h1-6,13,15,26H,7-12,16,24H2
• InChIKey: SOHCKWZVTCTQBG-UHFFFAOYSA-N