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

Systemtic Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride Openeye Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride CAS Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride IUPAC Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium chloride Traditional Name: 1-(4-nitrobenzyl)piperidin-1-ium chloride Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C12H16N2O2.ClH/c15-14(16)12-6-4-11(5-7-12)10-13-8-2-1-3-9-13;/h4-7H,1-3,8-10H2;1H