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

Systemtic Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-N-phenethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-phenethylacetamide Traditional Name: N-benzyl-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-phenethyl-acetamide Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4O

InChI

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