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

Systemtic Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride Openeye Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride CAS Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride IUPAC Name: 1-methyl-1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride Traditional Name: 1-methyl-1-(4-nitrobenzyl)piperidin-1-ium chloride Formula: C13H19ClN2O2 MolecularWeight: 270.75516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N2O2.ClH/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;1H/q+1;/p-1