N-(2-ethylphenyl)-2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[3-(1H-indol-3-yl)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C25H31N4O2+ MolecularWeight: 419.53924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H30N4O2/c1-2-19-7-3-5-9-22(19)27-24(30)18-28-13-15-29(16-14-28)25(31)12-11-20-17-26-23-10-6-4-8-21(20)23/h3-10,17,26H,2,11-16,18H2,1H3,(H,27,30)/p+1