2-nitro-6-[(E)-[(3,4,5-trimethoxy-2-nitro-phenyl)carbonylhydrazinylidene]methyl]phenolate

Systemtic Name: 2-nitro-6-[(E)-[(3,4,5-trimethoxy-2-nitro-phenyl)carbonylhydrazinylidene]methyl]phenolate Openeye Name: 2-nitro-6-[(E)-[(3,4,5-trimethoxy-2-nitro-benzoyl)hydrazono]methyl]phenolate CAS Name: 2-nitro-6-[(E)-[[oxo-(3,4,5-trimethoxy-2-nitrophenyl)methyl]hydrazinylidene]methyl]phenolate IUPAC Name: 2-nitro-6-[(E)-[(3,4,5-trimethoxy-2-nitrobenzoyl)hydrazinylidene]methyl]phenolate Traditional Name: 2-nitro-6-[(E)-[(3,4,5-trimethoxy-2-nitro-benzoyl)hydrazono]methyl]phenolate Formula: C17H15N4O9- MolecularWeight: 419.3224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NN=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-])[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)N/N=C/C2=C(C(=CC=C2)[N+](=O)[O-])[O-])[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H16N4O9/c1-28-12-7-10(13(21(26)27)16(30-3)15(12)29-2)17(23)19-18-8-9-5-4-6-11(14(9)22)20(24)25/h4-8,22H,1-3H3,(H,19,23)/p-1/b18-8+