N-butyl-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-butyl-2-[4-(1-naphthalenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-butyl-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-butyl-2-[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C21H31N3O+2 MolecularWeight: 341.49034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H29N3O/c1-2-3-11-22-21(25)17-24-14-12-23(13-15-24)16-19-9-6-8-18-7-4-5-10-20(18)19/h4-10H,2-3,11-17H2,1H3,(H,22,25)/p+2