4-ethyl-1-[(2-nitrophenyl)methyl]-1-(phenylmethyl)piperidin-1-ium

Systemtic Name: 4-ethyl-1-[(2-nitrophenyl)methyl]-1-(phenylmethyl)piperidin-1-ium Openeye Name: 1-benzyl-4-ethyl-1-[(2-nitrophenyl)methyl]piperidin-1-ium CAS Name: 4-ethyl-1-[(2-nitrophenyl)methyl]-1-(phenylmethyl)piperidin-1-ium IUPAC Name: 1-benzyl-4-ethyl-1-[(2-nitrophenyl)methyl]piperidin-1-ium Traditional Name: 1-benzyl-4-ethyl-1-(2-nitrobenzyl)piperidin-1-ium Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC[N+](CC1)(CC2=CC=CC=C2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC1CC[N+](CC1)(CC2=CC=CC=C2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H27N2O2/c1-2-18-12-14-23(15-13-18,16-19-8-4-3-5-9-19)17-20-10-6-7-11-21(20)22(24)25/h3-11,18H,2,12-17H2,1H3/q+1