N'-cyclohexyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ethanediamide

Systemtic Name: N'-cyclohexyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ethanediamide Openeye Name: N'-cyclohexyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]oxamide CAS Name: N'-cyclohexyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]oxamide IUPAC Name: N'-cyclohexyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]oxamide Traditional Name: N'-cyclohexyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]oxamide Formula: C22H36N4O3+2 MolecularWeight: 404.54624

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C(CNC(=O)C(=O)NC2CCCCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H](CNC(=O)C(=O)NC2CCCCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H34N4O3/c1-25-12-14-26(15-13-25)20(17-8-10-19(29-2)11-9-17)16-23-21(27)22(28)24-18-6-4-3-5-7-18/h8-11,18,20H,3-7,12-16H2,1-2H3,(H,23,27)(H,24,28)/p+2/t20-/m1/s1