methyl-[(3-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)azanium

Systemtic Name: methyl-[(3-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)azanium Openeye Name: methyl-[(3-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)ammonium CAS Name: methyl-[(3-nitrophenyl)methyl]-[2-(2-pyridin-1-iumyl)ethyl]ammonium IUPAC Name: methyl-[(3-nitrophenyl)methyl]-(2-pyridin-1-ium-2-ylethyl)azanium Traditional Name: methyl-(3-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(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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