2-(dimethylazaniumyl)ethyl-ethyl-[(4-nitrophenyl)methyl]azanium

Systemtic Name: 2-(dimethylazaniumyl)ethyl-ethyl-[(4-nitrophenyl)methyl]azanium Openeye Name: 2-(dimethylammonio)ethyl-ethyl-[(4-nitrophenyl)methyl]ammonium CAS Name: 2-(dimethylammonio)ethyl-ethyl-[(4-nitrophenyl)methyl]ammonium IUPAC Name: 2-(dimethylazaniumyl)ethyl-ethyl-[(4-nitrophenyl)methyl]azanium Traditional Name: 2-(dimethylammonio)ethyl-ethyl-(4-nitrobenzyl)ammonium Formula: C13H23N3O2+2 MolecularWeight: 253.34062

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC[NH+](C)C)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC[NH+](C)C)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O2/c1-4-15(10-9-14(2)3)11-12-5-7-13(8-6-12)16(17)18/h5-8H,4,9-11H2,1-3H3/p+2