N-(3-ethanoylphenyl)-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(3-acetylphenyl)-2-[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(3-acetylphenyl)-2-[4-(1-naphthalenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[4-(naphthalen-1-ylmethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(3-acetylphenyl)-2-[4-(1-naphthylmethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C25H29N3O2+2 MolecularWeight: 403.51666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H27N3O2/c1-19(29)21-8-5-10-23(16-21)26-25(30)18-28-14-12-27(13-15-28)17-22-9-4-7-20-6-2-3-11-24(20)22/h2-11,16H,12-15,17-18H2,1H3,(H,26,30)/p+2