N-tert-butyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[1-oxo-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C22H37N5O2+2 MolecularWeight: 403.56148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H35N5O2/c1-22(2,3)23-20(28)17-24-11-15-27(16-12-24)21(29)18-25-9-13-26(14-10-25)19-7-5-4-6-8-19/h4-8H,9-18H2,1-3H3,(H,23,28)/p+2