N-[2-(1H-indol-3-yl)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Formula: C25H31N4O+ MolecularWeight: 403.53984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCCC2=CNC3=CC=CC=C32)CC=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCCC2=CNC3=CC=CC=C32)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O/c30-25(26-13-12-22-19-27-24-11-5-4-10-23(22)24)20-29-17-15-28(16-18-29)14-6-9-21-7-2-1-3-8-21/h1-11,19,27H,12-18,20H2,(H,26,30)/p+1/b9-6+