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

Systemtic Name: 2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[1-oxo-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C21H35N5O2+2 MolecularWeight: 389.5349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N5O2/c1-18(2)22-20(27)16-23-10-14-26(15-11-23)21(28)17-24-8-12-25(13-9-24)19-6-4-3-5-7-19/h3-7,18H,8-17H2,1-2H3,(H,22,27)/p+2