2-(4-cyanopyridin-1-ium-1-yl)-N-[2-[2-[2-[2-[2-(4-isocyanopyridin-1-ium-1-yl)ethanoylamino]ethoxy]ethylcarbamoylamino]ethoxy]ethyl]ethanamide

Systemtic Name: 2-(4-cyanopyridin-1-ium-1-yl)-N-[2-[2-[2-[2-[2-(4-isocyanopyridin-1-ium-1-yl)ethanoylamino]ethoxy]ethylcarbamoylamino]ethoxy]ethyl]ethanamide Openeye Name: 2-(4-cyanopyridin-1-ium-1-yl)-N-[2-[2-[2-[2-[[2-(4-isocyanopyridin-1-ium-1-yl)acetyl]amino]ethoxy]ethylcarbamoylamino]ethoxy]ethyl]acetamide CAS Name: 2-(4-cyano-1-pyridin-1-iumyl)-N-[2-[2-[[[2-[2-[[2-(4-isocyano-1-pyridin-1-iumyl)-1-oxoethyl]amino]ethoxy]ethylamino]-oxomethyl]amino]ethoxy]ethyl]acetamide IUPAC Name: 2-(4-cyanopyridin-1-ium-1-yl)-N-[2-[2-[2-[2-[[2-(4-isocyanopyridin-1-ium-1-yl)acetyl]amino]ethoxy]ethylcarbamoylamino]ethoxy]ethyl]acetamide Traditional Name: 2-(4-cyanopyridin-1-ium-1-yl)-N-[2-[2-[2-[2-[[2-(4-isocyanopyridin-1-ium-1-yl)acetyl]amino]ethoxy]ethylcarbamoylamino]ethoxy]ethyl]acetamide Formula: C25H32N8O5+2 MolecularWeight: 524.57218

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=[N+](C=C1)CC(=O)NCCOCCNC(=O)NCCOCCNC(=O)C[N+]2=CC=C(C=C2)C#N

Isomeric SMILES

[C-]#[N+]C1=CC=[N+](C=C1)CC(=O)NCCOCCNC(=O)NCCOCCNC(=O)C[N+]2=CC=C(C=C2)C#N

InChI

InChI=1S/C25H30N8O5/c1-27-22-4-12-33(13-5-22)20-24(35)29-7-15-38-17-9-31-25(36)30-8-16-37-14-6-28-23(34)19-32-10-2-21(18-26)3-11-32/h2-5,10-13H,6-9,14-17,19-20H2,(H2-2,28,29,30,31,34,35,36)/p+2