2-[(E)-[2-(2,4-dimethylphenoxy)ethanoylhydrazinylidene]methyl]-4,6-dinitro-phenolate

Systemtic Name: 2-[(E)-[2-(2,4-dimethylphenoxy)ethanoylhydrazinylidene]methyl]-4,6-dinitro-phenolate Openeye Name: 2-[(E)-[[2-(2,4-dimethylphenoxy)acetyl]hydrazono]methyl]-4,6-dinitro-phenolate CAS Name: 2-[(E)-[[2-(2,4-dimethylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]-4,6-dinitrophenolate IUPAC Name: 2-[(E)-[[2-(2,4-dimethylphenoxy)acetyl]hydrazinylidene]methyl]-4,6-dinitrophenolate Traditional Name: 2-[(E)-[[2-(2,4-dimethylphenoxy)acetyl]hydrazono]methyl]-4,6-dinitro-phenolate Formula: C17H15N4O7- MolecularWeight: 387.3236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)N/N=C/C2=CC(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C17H16N4O7/c1-10-3-4-15(11(2)5-10)28-9-16(22)19-18-8-12-6-13(20(24)25)7-14(17(12)23)21(26)27/h3-8,23H,9H2,1-2H3,(H,19,22)/p-1/b18-8+