2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2S)-2-phenylbutyl]ethanamide

Systemtic Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2S)-2-phenylbutyl]ethanamide Openeye Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2S)-2-phenylbutyl]acetamide CAS Name: 2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-[(2S)-2-phenylbutyl]acetamide IUPAC Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2S)-2-phenylbutyl]acetamide Traditional Name: 2-(4-p-anisylpiperazine-1,4-diium-1-yl)-N-[(2S)-2-phenylbutyl]acetamide Formula: C24H35N3O2+2 MolecularWeight: 397.5536

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H33N3O2/c1-3-21(22-7-5-4-6-8-22)17-25-24(28)19-27-15-13-26(14-16-27)18-20-9-11-23(29-2)12-10-20/h4-12,21H,3,13-19H2,1-2H3,(H,25,28)/p+2/t21-/m1/s1