1-methyl-4-[1-[(2-nitrophenyl)methyl]piperidin-1-ium-4-yl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[1-[(2-nitrophenyl)methyl]piperidin-1-ium-4-yl]piperazin-1-ium Openeye Name: 1-methyl-4-[1-[(2-nitrophenyl)methyl]piperidin-1-ium-4-yl]piperazin-1-ium CAS Name: 1-methyl-4-[1-[(2-nitrophenyl)methyl]-4-piperidin-1-iumyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[1-[(2-nitrophenyl)methyl]piperidin-1-ium-4-yl]piperazin-1-ium Traditional Name: 1-methyl-4-[1-(2-nitrobenzyl)piperidin-1-ium-4-yl]piperazin-1-ium Formula: C17H28N4O2+2 MolecularWeight: 320.42982

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O2/c1-18-10-12-20(13-11-18)16-6-8-19(9-7-16)14-15-4-2-3-5-17(15)21(22)23/h2-5,16H,6-14H2,1H3/p+2