1-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-2-naphthalen-2-yloxy-ethanone

Systemtic Name: 1-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-2-naphthalen-2-yloxy-ethanone Openeye Name: 1-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-2-(2-naphthyloxy)ethanone CAS Name: 1-[4-(1H-indol-3-ylmethyl)-1-piperazin-4-iumyl]-2-(2-naphthalenyloxy)ethanone IUPAC Name: 1-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-2-naphthalen-2-yloxyethanone Traditional Name: 1-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-2-(2-naphthoxy)ethanone Formula: C25H26N3O2+ MolecularWeight: 400.49284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CNC3=CC=CC=C32)C(=O)COC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CNC3=CC=CC=C32)C(=O)COC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H25N3O2/c29-25(18-30-22-10-9-19-5-1-2-6-20(19)15-22)28-13-11-27(12-14-28)17-21-16-26-24-8-4-3-7-23(21)24/h1-10,15-16,26H,11-14,17-18H2/p+1