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

Systemtic Name: N'-(4-methylphenyl)-N-[2-[4-(4-methylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]ethanediamide Openeye Name: N-[2-[4-(4-methylbenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(p-tolyl)oxamide CAS Name: N'-(4-methylphenyl)-N-[2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]oxamide IUPAC Name: N-[2-[4-(4-methylbenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(4-methylphenyl)oxamide Traditional Name: N-[2-(4-p-toluoylpiperazin-1-ium-1-yl)ethyl]-N'-(p-tolyl)oxamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CCNC(=O)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CCNC(=O)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N4O3/c1-17-3-7-19(8-4-17)23(30)27-15-13-26(14-16-27)12-11-24-21(28)22(29)25-20-9-5-18(2)6-10-20/h3-10H,11-16H2,1-2H3,(H,24,28)(H,25,29)/p+1