N-[2-[4-(4-bromophenyl)carbonylpiperazin-1-ium-1-yl]ethyl]-N'-(4-ethylphenyl)ethanediamide

Systemtic Name: N-[2-[4-(4-bromophenyl)carbonylpiperazin-1-ium-1-yl]ethyl]-N'-(4-ethylphenyl)ethanediamide Openeye Name: N-[2-[4-(4-bromobenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(4-ethylphenyl)oxamide CAS Name: N-[2-[4-[(4-bromophenyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]-N'-(4-ethylphenyl)oxamide IUPAC Name: N-[2-[4-(4-bromobenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(4-ethylphenyl)oxamide Traditional Name: N-[2-[4-(4-bromobenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(4-ethylphenyl)oxamide Formula: C23H28BrN4O3+ MolecularWeight: 488.39742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H27BrN4O3/c1-2-17-3-9-20(10-4-17)26-22(30)21(29)25-11-12-27-13-15-28(16-14-27)23(31)18-5-7-19(24)8-6-18/h3-10H,2,11-16H2,1H3,(H,25,29)(H,26,30)/p+1