4-[(E)-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylhydrazinylidene]methyl]-2-ethoxy-6-nitro-phenolate

Systemtic Name: 4-[(E)-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylhydrazinylidene]methyl]-2-ethoxy-6-nitro-phenolate Openeye Name: 4-[(E)-[[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]hydrazono]methyl]-2-ethoxy-6-nitro-phenolate CAS Name: 4-[(E)-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]hydrazinylidene]methyl]-2-ethoxy-6-nitrophenolate IUPAC Name: 4-[(E)-[[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]hydrazinylidene]methyl]-2-ethoxy-6-nitrophenolate Traditional Name: 4-[(E)-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]hydrazono]methyl]-2-ethoxy-6-nitro-phenolate Formula: C18H16N3O7- MolecularWeight: 386.33554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=NNC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=N/NC(=O)[C@@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H17N3O7/c1-2-26-15-8-11(7-12(17(15)22)21(24)25)9-19-20-18(23)16-10-27-13-5-3-4-6-14(13)28-16/h3-9,16,22H,2,10H2,1H3,(H,20,23)/p-1/b19-9+/t16-/m0/s1