2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N,N-bis(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N,N-bis(phenylmethyl)ethanamide Openeye Name: N,N-dibenzyl-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-N,N-bis(phenylmethyl)acetamide IUPAC Name: N,N-dibenzyl-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dibenzyl-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C26H29N3O2/c30-25-14-8-7-13-24(25)28-17-15-27(16-18-28)21-26(31)29(19-22-9-3-1-4-10-22)20-23-11-5-2-6-12-23/h1-14,30H,15-21H2/p+1