N'-(4-methoxyphenyl)-N-[2-[4-(3-methylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-methoxyphenyl)-N-[2-[4-(3-methylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]ethanediamide Openeye Name: N'-(4-methoxyphenyl)-N-[2-[4-(3-methylbenzoyl)piperazin-1-ium-1-yl]ethyl]oxamide CAS Name: N'-(4-methoxyphenyl)-N-[2-[4-[(3-methylphenyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]oxamide IUPAC Name: N'-(4-methoxyphenyl)-N-[2-[4-(3-methylbenzoyl)piperazin-1-ium-1-yl]ethyl]oxamide Traditional Name: N'-(4-methoxyphenyl)-N-[2-(4-m-toluoylpiperazin-1-ium-1-yl)ethyl]oxamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O4/c1-17-4-3-5-18(16-17)23(30)27-14-12-26(13-15-27)11-10-24-21(28)22(29)25-19-6-8-20(31-2)9-7-19/h3-9,16H,10-15H2,1-2H3,(H,24,28)(H,25,29)/p+1