2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-N-[2-(phenylmethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-N-[2-(phenylmethyl)phenyl]ethanamide Openeye Name: N-(2-benzylphenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]-N-[2-(phenylmethyl)phenyl]acetamide IUPAC Name: N-(2-benzylphenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-benzylphenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C27H33N3O2+2 MolecularWeight: 431.56982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c31-27(28-26-14-8-7-11-24(26)21-23-9-3-1-4-10-23)22-30-17-15-29(16-18-30)19-20-32-25-12-5-2-6-13-25/h1-14H,15-22H2,(H,28,31)/p+2