(3,5-dinitrophenyl)methyl-bis(2-hydroxyethyl)-methyl-azanium

Systemtic Name: (3,5-dinitrophenyl)methyl-bis(2-hydroxyethyl)-methyl-azanium Openeye Name: (3,5-dinitrophenyl)methyl-bis(2-hydroxyethyl)-methyl-ammonium CAS Name: (3,5-dinitrophenyl)methyl-bis(2-hydroxyethyl)-methylammonium IUPAC Name: (3,5-dinitrophenyl)methyl-bis(2-hydroxyethyl)-methylazanium Traditional Name: (3,5-dinitrobenzyl)-bis(2-hydroxyethyl)-methyl-ammonium Formula: C12H18N3O6+ MolecularWeight: 300.28782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N3O6/c1-15(2-4-16,3-5-17)9-10-6-11(13(18)19)8-12(7-10)14(20)21/h6-8,16-17H,2-5,9H2,1H3/q+1