3-[(E)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]-4-nitro-phenolate

Systemtic Name: 3-[(E)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]-4-nitro-phenolate Openeye Name: 3-[(E)-(1,3-benzodioxole-5-carbonylhydrazono)methyl]-4-nitro-phenolate CAS Name: 3-[(E)-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 3-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]-4-nitrophenolate Traditional Name: 4-nitro-3-[(E)-(piperonyloylhydrazono)methyl]phenolate Formula: C15H10N3O6- MolecularWeight: 328.2564

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NN=CC3=C(C=CC(=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)N/N=C/C3=C(C=CC(=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O6/c19-11-2-3-12(18(21)22)10(5-11)7-16-17-15(20)9-1-4-13-14(6-9)24-8-23-13/h1-7,19H,8H2,(H,17,20)/p-1/b16-7+