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

Systemtic Name: N'-cyclopentyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ethanediamide Openeye Name: N'-cyclopentyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]oxamide CAS Name: N'-cyclopentyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]oxamide IUPAC Name: N'-cyclopentyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]oxamide Traditional Name: N'-cyclopentyl-N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]oxamide Formula: C21H34N4O3+2 MolecularWeight: 390.51966

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C(CNC(=O)C(=O)NC2CCCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H](CNC(=O)C(=O)NC2CCCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H32N4O3/c1-24-11-13-25(14-12-24)19(16-7-9-18(28-2)10-8-16)15-22-20(26)21(27)23-17-5-3-4-6-17/h7-10,17,19H,3-6,11-15H2,1-2H3,(H,22,26)(H,23,27)/p+2/t19-/m1/s1