2-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethylamino]ethylazanium

Systemtic Name: 2-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethylamino]ethylazanium Openeye Name: 2-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethylamino]ethylammonium CAS Name: 2-[2-[2-(4-methyl-2-nitrophenoxy)ethoxy]ethylamino]ethylammonium IUPAC Name: 2-[2-[2-(4-methyl-2-nitrophenoxy)ethoxy]ethylamino]ethylazanium Traditional Name: 2-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethylamino]ethylammonium Formula: C13H22N3O4+ MolecularWeight: 284.33148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCOCCNCC[NH3+])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCCOCCNCC[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O4/c1-11-2-3-13(12(10-11)16(17)18)20-9-8-19-7-6-15-5-4-14/h2-3,10,15H,4-9,14H2,1H3/p+1