piperazin-4-ium-1-yl-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: piperazin-4-ium-1-yl-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: piperazin-4-ium-1-yl-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: 1-piperazin-4-iumyl-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: piperazin-4-ium-1-yl-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: piperazin-4-ium-1-yl-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C14H23N5O+2 MolecularWeight: 277.36532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C14H21N5O/c20-14(18-7-5-15-6-8-18)19-11-9-17(10-12-19)13-3-1-2-4-16-13/h1-4,15H,5-12H2/p+2