(2S)-N-[2-(1H-indol-3-yl)ethyl]-2-piperazin-1-ium-1-yl-propanamide

Systemtic Name: (2S)-N-[2-(1H-indol-3-yl)ethyl]-2-piperazin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-[2-(1H-indol-3-yl)ethyl]-2-piperazin-1-ium-1-yl-propanamide CAS Name: (2S)-N-[2-(1H-indol-3-yl)ethyl]-2-(1-piperazin-1-iumyl)propanamide IUPAC Name: (2S)-N-[2-(1H-indol-3-yl)ethyl]-2-piperazin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-[2-(1H-indol-3-yl)ethyl]-2-piperazin-1-ium-1-yl-propionamide Formula: C17H25N4O+ MolecularWeight: 301.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CNC2=CC=CC=C21)[NH+]3CCNCC3

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CNC2=CC=CC=C21)[NH+]3CCNCC3

InChI

InChI=1S/C17H24N4O/c1-13(21-10-8-18-9-11-21)17(22)19-7-6-14-12-20-16-5-3-2-4-15(14)16/h2-5,12-13,18,20H,6-11H2,1H3,(H,19,22)/p+1/t13-/m0/s1