methyl-[(4-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)azanium

Systemtic Name: methyl-[(4-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)azanium Openeye Name: methyl-[(4-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)ammonium CAS Name: methyl-[(4-nitrophenyl)methyl]-[2-(2-pyridin-1-iumyl)ethyl]ammonium IUPAC Name: methyl-[(4-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)azanium Traditional Name: methyl-(4-nitrobenzyl)-(2-pyridin-1-ium-2-ylethyl)ammonium Formula: C15H19N3O2+2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=[NH+]1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CCC1=CC=CC=[NH+]1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O2/c1-17(11-9-14-4-2-3-10-16-14)12-13-5-7-15(8-6-13)18(19)20/h2-8,10H,9,11-12H2,1H3/p+2