1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium

Systemtic Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium Openeye Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium CAS Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium IUPAC Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium Traditional Name: 1-methyl-1-(4-nitrobenzyl)piperidin-1-ium Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[N+]1(CCCCC1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N2O2/c1-15(9-3-2-4-10-15)11-12-5-7-13(8-6-12)14(16)17/h5-8H,2-4,9-11H2,1H3/q+1