N'-phenyl-N-[2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethyl]ethanediamide

Systemtic Name: N'-phenyl-N-[2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethyl]ethanediamide Openeye Name: N-[2-(4-benzoylpiperazin-1-ium-1-yl)ethyl]-N'-phenyl-oxamide CAS Name: N-[2-(4-benzoyl-1-piperazin-1-iumyl)ethyl]-N'-phenyloxamide IUPAC Name: N-[2-(4-benzoylpiperazin-1-ium-1-yl)ethyl]-N'-phenyloxamide Traditional Name: N-[2-(4-benzoylpiperazin-1-ium-1-yl)ethyl]-N'-phenyl-oxamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C(=O)NC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C(=O)NC2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3/c26-19(20(27)23-18-9-5-2-6-10-18)22-11-12-24-13-15-25(16-14-24)21(28)17-7-3-1-4-8-17/h1-10H,11-16H2,(H,22,26)(H,23,27)/p+1