N-ethylethanamine; 2-methyl-4,6-dinitro-phenolate

Systemtic Name: N-ethylethanamine; 2-methyl-4,6-dinitro-phenolate Openeye Name: N-ethylethanamine; 2-methyl-4,6-dinitro-phenolate CAS Name: N-ethylethanamine; 2-methyl-4,6-dinitrophenolate IUPAC Name: N-ethylethanamine; 2-methyl-4,6-dinitrophenolate Traditional Name: diethylamine; 2-methyl-4,6-dinitro-phenolate Formula: C11H16N3O5- MolecularWeight: 270.26184

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCNCC.CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H6N2O5.C4H11N/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14;1-3-5-4-2/h2-3,10H,1H3;5H,3-4H2,1-2H3/p-1