N-[[4-(ethoxymethyl)phenyl]methyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[[4-(ethoxymethyl)phenyl]methyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[[4-(ethoxymethyl)phenyl]methyl]acetamide CAS Name: N-[[4-(ethoxymethyl)phenyl]methyl]-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[[4-(ethoxymethyl)phenyl]methyl]acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[4-(ethoxymethyl)benzyl]acetamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)CNC(=O)C[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOCC1=CC=C(C=C1)CNC(=O)C[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2/c1-2-28-19-22-10-8-20(9-11-22)16-24-23(27)18-26-14-12-25(13-15-26)17-21-6-4-3-5-7-21/h3-11H,2,12-19H2,1H3,(H,24,27)/p+1