ethyl-methyl-(3-methyl-2,4-dinitro-phenyl)-propyl-azanium

Systemtic Name: ethyl-methyl-(3-methyl-2,4-dinitro-phenyl)-propyl-azanium Openeye Name: ethyl-methyl-(3-methyl-2,4-dinitro-phenyl)-propyl-ammonium CAS Name: ethyl-methyl-(3-methyl-2,4-dinitrophenyl)-propylammonium IUPAC Name: ethyl-methyl-(3-methyl-2,4-dinitrophenyl)-propylazanium Traditional Name: ethyl-methyl-(3-methyl-2,4-dinitro-phenyl)-propyl-ammonium Formula: C13H20N3O4+ MolecularWeight: 282.3156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N3O4/c1-5-9-16(4,6-2)12-8-7-11(14(17)18)10(3)13(12)15(19)20/h7-8H,5-6,9H2,1-4H3/q+1